null ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 15:32:41 on 14 Sep 2019 + ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ Please cite: I. Uson & G.M. Sheldrick (2018), "An introduction to experimental phasing of macromolecules illustrated by SHELX; new autotracing features" Acta Cryst. D74, 106-116 (Open Access) if SHELXE proves useful. Command line parameters: ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.phi -a -n -t20 Cell and symmetry only from ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.ins Phases from ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.phi Native data from ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.hkl Listing output to ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.lst Phases output to ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.phs Poly-Ala trace output to ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.pdb Summary of parameters to be employed: -a 30 global autotracing cycles, stop 3 cycles after CC>30 -b 5.0 extra B for revised heavy atom sites -c 0.400 fraction of pixels in crossover region -d 0.000 high resolution limit to be applied to input data -D unset do not fuse disulfides for NCS -e unset fill in missing data up to maximum resolution + 0.2 Ang. -f unset read intensity not F from native .hkl file -F 0.800 fractional weight for phases from previous global cycle -g 1.100 solvent gamma flipping factor -G 0.700 FOM threshold for initial tripeptides and chain building -i unset no structure inversion -k 4.5 minimum height/sigma for revised heavy atom sites -l 2 space for 2000000 reflections -L 6 minimum number of residues/chain (if more than 3 chains) -m 10 cycles of density modification -p unset no phosphate search -q unset no alpha-helix search -r 3.00 map resolution (multiplies maximum indices) -s 0.450 solvent fraction -S 2.42 radius of sphere of influence -t 10.00 time for initial searches (-t6 or more if difficult) -u 500 MB allocatable memory for fragment optimization -v unset density sharpening factor dependent on resolution -w 0.200 weight for experimental phases after cycle 1 -x unset no phase and trace diagnostics -z unset do not optimize heavy atoms Space group: P 1 21 1 Allowed origin shift code: 2 272043 Reflections read from file ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.phi 272043 Reflections read from file ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.hkl 272043 Unique data, highest resolution = 2.201 Angstroms Anisotropic scaling: intensities multiplied by 0.000034h^2 -0.000049k^2 +0.000016l^2 +0.000000kl +0.000067hl +0.000000hk 1006 Reflections with d > 2.401 and 0 in range 2.401 > d > 2.201 added Density sharpening factor set to 0.45 Fourier grid = 512 x 128 x 133 0.000 <= z <= 0.500 92 Point spherical net set up with radius 2.42A 32 Extra Fourier layers will be generated <|E^2-1|> = 0.558 ** -f missing ?? ** = 0.294, Contrast = 0.345, Connect. = 0.693 for dens.mod. cycle 1 = 0.300, Contrast = 0.387, Connect. = 0.672 for dens.mod. cycle 2 = 0.300, Contrast = 0.566, Connect. = 0.727 for dens.mod. cycle 3 = 0.300, Contrast = 0.677, Connect. = 0.750 for dens.mod. cycle 4 = 0.300, Contrast = 0.756, Connect. = 0.763 for dens.mod. cycle 5 = 0.300, Contrast = 0.816, Connect. = 0.773 for dens.mod. cycle 6 = 0.300, Contrast = 0.865, Connect. = 0.781 for dens.mod. cycle 7 = 0.300, Contrast = 0.904, Connect. = 0.786 for dens.mod. cycle 8 = 0.300, Contrast = 0.935, Connect. = 0.791 for dens.mod. cycle 9 = 0.300, Contrast = 0.962, Connect. = 0.794 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 16629 peaks > 0.5 sigma used to seed fragment search Space for about 6134 unique residues taking solvent into account 2723 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 19 38.414 2.277 1.072 0.879 0.944 0.889 CA 1.474 B: 11 38.501 2.437 1.472 0.898 0.800 0.600 CA 1.807 C: 25 62.578 2.357 1.256 0.905 1.000 0.792 CA 1.710 11 residues pruned to eliminate duplicates D: 26 49.895 2.338 0.969 0.883 0.960 0.920 CA 1.632 19 residues pruned to eliminate duplicates E: 13 31.264 2.253 0.945 0.857 1.000 0.500 CA 1.518 13 residues pruned to eliminate duplicates F: 24 45.538 2.376 0.898 0.928 1.000 0.870 CA 1.474 G: 24 56.953 2.377 1.313 0.889 0.913 0.522 CB 1.703 24 residues pruned to eliminate duplicates H: 24 48.980 2.376 0.870 0.884 1.000 0.913 CA 1.661 24 residues pruned to eliminate duplicates I: 10 36.211 2.555 1.085 0.919 1.000 0.889 CA 1.597 10 residues pruned to eliminate duplicates J: 26 40.950 2.258 1.239 0.859 0.920 0.760 CA 1.296 K: 24 62.276 2.339 1.372 0.901 1.000 0.696 CA 1.670 25 residues pruned to eliminate duplicates L: 26 54.468 2.291 1.395 0.873 0.920 0.520 CA 1.572 26 residues pruned to eliminate duplicates M: 26 60.871 2.293 1.297 0.874 1.000 0.640 CA 1.682 24 residues pruned to eliminate duplicates N: 25 40.010 2.292 0.754 0.906 1.000 0.750 CA 1.444 O: 8 11.914 2.281 0.709 0.434 0.857 0.714 CB 1.442 P: 8 6.257 2.181 0.235 0.361 0.714 0.429 CB 1.427 Q: 21 35.323 2.156 0.828 0.934 1.000 1.000 CA 1.398 R: 26 40.163 2.284 0.863 0.868 0.960 0.840 CA 1.437 26 residues pruned to eliminate duplicates S: 24 57.443 2.371 1.328 0.929 0.957 0.696 CA 1.588 25 residues pruned to eliminate duplicates T: 24 55.099 2.396 1.272 0.890 0.913 0.522 CB 1.663 24 residues pruned to eliminate duplicates U: 13 15.197 1.984 0.883 0.358 0.833 0.500 CB 1.641 V: 26 43.278 2.211 1.166 0.919 1.000 0.880 CA 1.274 25 residues pruned to eliminate duplicates W: 22 59.618 2.415 1.385 0.918 0.952 0.524 CB 1.673 22 residues pruned to eliminate duplicates X: 22 55.983 2.440 1.097 0.928 1.000 0.571 CB 1.672 23 residues pruned to eliminate duplicates Y: 24 45.130 2.269 1.054 0.858 0.870 0.522 CB 1.710 24 residues pruned to eliminate duplicates Z: 20 46.204 2.217 1.109 0.927 1.000 0.895 CA 1.588 20 residues pruned to eliminate duplicates Z: 10 27.456 1.978 1.345 0.853 1.000 0.778 CA 1.458 Z: 19 49.145 2.264 1.117 0.886 0.944 0.722 CB 1.847 Z: 18 27.624 2.147 0.760 0.870 0.941 0.824 CA 1.375 Z: 26 38.758 2.203 1.032 0.876 0.960 0.800 CA 1.311 27 residues pruned to eliminate duplicates Z: 25 61.820 2.344 1.528 0.924 1.000 0.792 CA 1.495 25 residues pruned to eliminate duplicates Z: 25 57.031 2.343 1.402 0.911 0.958 0.458 CB 1.530 24 residues pruned to eliminate duplicates Z: 26 42.624 2.299 0.849 0.848 0.960 0.880 CA 1.549 26 residues pruned to eliminate duplicates Z: 29 37.279 2.070 0.845 0.876 0.929 0.786 CA 1.444 Z: 24 59.267 2.398 1.349 0.932 0.957 0.739 CA 1.603 24 residues pruned to eliminate duplicates Z: 25 63.491 2.402 1.366 0.919 0.958 0.708 CB 1.676 24 residues pruned to eliminate duplicates Z: 14 27.463 2.294 1.036 0.877 0.923 0.846 CA 1.283 14 residues pruned to eliminate duplicates Z: 16 39.039 2.403 1.045 0.864 0.933 0.400 CB 1.612 16 residues pruned to eliminate duplicates Z: 24 54.487 2.365 1.264 0.918 0.957 0.783 CB 1.564 24 residues pruned to eliminate duplicates Z: 11 24.599 1.949 0.994 0.870 0.900 0.800 CB 1.624 Z: 20 53.641 2.243 1.268 0.910 0.947 0.526 CA 1.811 19 residues pruned to eliminate duplicates Z: 26 59.902 2.298 1.371 0.885 0.960 0.720 CA 1.653 26 residues pruned to eliminate duplicates Z: 23 67.418 2.475 1.496 0.913 0.955 0.636 CA 1.725 25 residues pruned to eliminate duplicates Z: 9 21.618 2.230 0.926 0.852 1.000 0.625 CA 1.316 9 residues pruned to eliminate duplicates Z: 7 7.050 1.821 1.162 0.344 0.833 0.500 CB 1.040 Z: 18 29.184 2.198 0.999 0.824 0.824 0.765 CA 1.478 18 residues pruned to eliminate duplicates Z: 25 43.742 2.253 1.070 0.937 1.000 0.875 CA 1.332 25 residues pruned to eliminate duplicates Z: 13 35.018 2.204 1.190 0.878 1.000 0.583 CB 1.520 16 residues pruned to eliminate duplicates Z: 17 30.627 2.150 1.059 0.935 0.938 0.812 CA 1.285 Z: 20 32.060 2.133 0.788 0.863 1.000 0.632 CA 1.414 18 residues pruned to eliminate duplicates Z: 18 33.390 2.226 1.119 0.938 0.941 0.765 CA 1.268 17 residues pruned to eliminate duplicates Z: 25 46.372 2.313 1.044 0.921 1.000 0.750 CA 1.409 25 residues pruned to eliminate duplicates Z: 25 53.304 2.394 1.293 0.876 0.958 0.667 CA 1.504 25 residues pruned to eliminate duplicates Z: 25 51.342 2.361 1.153 0.926 0.958 0.875 CA 1.508 25 residues pruned to eliminate duplicates Z: 10 13.173 1.938 0.511 0.666 0.889 0.556 N 1.446 Z: 12 20.466 1.835 0.621 0.895 1.000 0.909 CA 1.488 12 residues pruned to eliminate duplicates Z: 20 36.791 2.305 1.226 0.833 0.789 0.579 CA 1.563 20 residues pruned to eliminate duplicates Z: 19 32.579 2.086 0.799 0.862 1.000 0.667 CA 1.503 Z: 23 47.037 2.362 1.110 0.890 0.955 0.818 CB 1.516 23 residues pruned to eliminate duplicates Z: 24 57.236 2.409 1.670 0.896 0.913 0.522 CB 1.456 24 residues pruned to eliminate duplicates Z: 11 19.449 1.962 0.562 0.831 1.000 0.900 CA 1.507 11 residues pruned to eliminate duplicates Z: 8 18.911 2.135 0.921 0.826 1.000 0.857 CA 1.314 Z: 18 56.010 2.329 1.449 0.925 1.000 0.647 CA 1.671 20 residues pruned to eliminate duplicates Z: 18 35.432 2.150 1.256 0.935 0.941 0.765 CA 1.311 18 residues pruned to eliminate duplicates Z: 18 41.404 2.248 1.260 0.921 0.941 0.706 CA 1.477 Z: 12 37.043 2.271 1.529 0.940 1.000 0.545 CA 1.350 12 residues pruned to eliminate duplicates Z: 24 48.041 2.402 1.001 0.898 0.957 0.696 CA 1.559 24 residues pruned to eliminate duplicates Z: 12 21.621 1.985 0.602 0.906 1.000 0.818 CA 1.457 Z: 12 22.104 1.833 0.707 0.895 1.000 1.000 CB 1.527 12 residues pruned to eliminate duplicates Z: 9 17.586 2.143 0.776 0.793 0.750 0.625 CA 1.684 Z: 8 11.956 1.868 0.499 0.796 1.000 0.571 CA 1.245 8 residues pruned to eliminate duplicates Z: 14 46.462 2.400 1.339 0.942 1.000 0.923 CA 1.592 15 residues pruned to eliminate duplicates Z: 10 15.725 1.766 0.793 0.777 0.889 0.778 CB 1.458 Z: 12 19.913 2.058 0.530 0.869 1.000 0.636 CA 1.393 Z: 20 64.744 2.264 1.587 0.893 1.000 0.632 CA 1.821 20 residues pruned to eliminate duplicates Z: 10 17.515 1.876 0.987 0.850 0.889 0.667 CA 1.305 9 residues pruned to eliminate duplicates Z: 23 50.789 2.312 1.275 0.919 0.955 0.500 CB 1.520 24 residues pruned to eliminate duplicates Z: 25 47.226 2.298 1.386 0.899 0.875 0.500 CB 1.436 25 residues pruned to eliminate duplicates Z: 19 42.372 2.203 1.135 0.911 1.000 0.778 CA 1.505 18 residues pruned to eliminate duplicates Z: 11 13.829 1.916 0.547 0.776 0.900 0.700 CA 1.285 Z: 7 10.493 2.024 0.771 0.672 0.667 0.333 CB 1.530 Z: 21 47.858 2.188 1.184 0.896 0.950 0.650 CA 1.689 21 residues pruned to eliminate duplicates Z: 26 50.991 2.229 1.264 0.863 0.880 0.560 CA 1.685 25 residues pruned to eliminate duplicates Z: 9 20.995 2.098 1.112 0.783 0.875 0.375 CA 1.492 Z: 20 32.780 1.894 1.155 0.905 0.895 0.579 CA 1.466 Z: 12 19.858 1.928 0.752 0.886 0.909 0.909 CA 1.407 12 residues pruned to eliminate duplicates Z: 10 12.202 1.992 0.496 0.662 0.778 0.667 CA 1.510 Z: 11 21.462 1.849 0.758 0.902 1.000 0.700 CB 1.489 Z: 11 29.724 2.457 0.985 0.910 1.000 0.800 CA 1.367 12 residues pruned to eliminate duplicates Z: 24 55.592 2.414 1.290 0.907 0.870 0.478 CB 1.714 24 residues pruned to eliminate duplicates Z: 20 29.963 1.868 1.187 0.884 0.947 0.474 CB 1.283 Z: 21 33.663 2.006 0.885 0.865 1.000 0.650 CA 1.459 20 residues pruned to eliminate duplicates Z: 24 55.762 2.333 1.144 0.909 0.957 0.609 CB 1.724 24 residues pruned to eliminate duplicates Z: 9 6.607 1.798 0.900 0.238 0.750 0.250 CB 1.235 Z: 23 52.868 2.391 1.127 0.931 0.955 0.591 CB 1.622 24 residues pruned to eliminate duplicates Z: 7 13.885 1.977 0.932 0.805 0.833 0.667 CA 1.365 Z: 20 45.016 2.252 1.235 0.913 0.842 0.526 CA 1.724 19 residues pruned to eliminate duplicates Z: 10 19.075 1.993 1.194 0.767 0.889 0.444 CA 1.291 9 residues pruned to eliminate duplicates Z: 19 31.410 2.001 0.724 0.898 1.000 0.889 CA 1.534 Z: 19 33.917 2.174 1.171 0.913 1.000 0.833 CA 1.199 19 residues pruned to eliminate duplicates Z: 12 19.091 1.975 0.790 0.820 0.818 0.455 CB 1.508 12 residues pruned to eliminate duplicates Z: 13 18.599 1.887 0.823 0.862 0.917 0.833 CA 1.250 13 residues pruned to eliminate duplicates Z: 27 40.115 2.278 0.681 0.833 0.923 0.731 CA 1.670 27 residues pruned to eliminate duplicates Z: 23 35.759 2.254 1.226 0.852 0.773 0.364 CB 1.454 23 residues pruned to eliminate duplicates Z: 19 39.694 2.292 1.163 0.908 0.944 0.722 CA 1.420 Z: 23 50.357 2.293 1.372 0.877 0.909 0.364 CA 1.576 23 residues pruned to eliminate duplicates Z: 19 54.559 2.352 1.300 0.932 0.944 0.556 CB 1.758 19 residues pruned to eliminate duplicates Z: 7 10.111 1.639 0.711 0.845 0.833 0.667 CA 1.313 Z: 21 34.369 2.016 0.894 0.886 1.000 0.800 CA 1.452 21 residues pruned to eliminate duplicates Z: 8 7.588 2.004 1.344 0.368 0.857 0.429 CB 0.821 Z: 30 18.929 1.999 0.766 0.461 0.828 0.483 CB 1.251 Z: 26 48.301 2.204 1.294 0.904 0.960 0.360 CA 1.417 26 residues pruned to eliminate duplicates Z: 41 31.421 2.186 0.761 0.456 0.925 0.625 CB 1.459 8 residues pruned to eliminate duplicates Z: 19 32.496 2.151 0.866 0.857 0.889 0.667 CB 1.582 20 residues pruned to eliminate duplicates Z: 8 15.186 1.936 0.657 0.839 1.000 0.714 CA 1.336 8 residues pruned to eliminate duplicates Z: 19 29.633 2.128 1.158 0.885 0.944 0.556 CA 1.162 19 residues pruned to eliminate duplicates Z: 7 13.135 2.088 0.705 0.801 0.833 0.833 CA 1.389 Z: 24 48.085 2.263 1.410 0.889 0.870 0.522 CB 1.522 25 residues pruned to eliminate duplicates Z: 18 25.250 2.106 0.705 0.872 0.882 0.647 CA 1.408 18 residues pruned to eliminate duplicates Z: 15 34.711 2.176 1.261 0.889 1.000 0.643 CB 1.358 15 residues pruned to eliminate duplicates Z: 17 37.224 2.307 0.890 0.945 1.000 0.938 CA 1.478 16 residues pruned to eliminate duplicates Z: 6 9.402 1.624 0.717 0.749 1.000 0.800 CB 1.208 Z: 19 37.296 2.278 0.789 0.910 1.000 0.778 CA 1.529 19 residues pruned to eliminate duplicates Z: 20 25.257 1.856 0.778 0.900 1.000 0.842 CA 1.255 20 residues pruned to eliminate duplicates Z: 21 14.877 1.823 0.634 0.466 0.950 0.650 CB 1.218 Z: 19 26.476 1.890 1.036 0.897 1.000 0.833 CB 1.161 19 residues pruned to eliminate duplicates Z: 22 27.788 2.242 0.893 0.939 0.952 0.905 CA 1.042 22 residues pruned to eliminate duplicates Z: 15 14.335 1.918 0.684 0.346 0.929 0.500 CB 1.510 Z: 13 32.016 2.260 0.953 0.925 1.000 0.917 CB 1.469 13 residues pruned to eliminate duplicates Z: 19 36.434 2.058 0.922 0.879 1.000 0.778 CB 1.574 19 residues pruned to eliminate duplicates Z: 12 25.950 1.966 0.880 0.886 1.000 0.727 CA 1.528 12 residues pruned to eliminate duplicates Z: 7 19.238 2.103 1.358 0.787 1.000 0.667 CA 1.231 7 residues pruned to eliminate duplicates Z: 16 22.900 2.068 0.973 0.825 0.867 0.533 CB 1.262 16 residues pruned to eliminate duplicates Z: 20 55.341 2.239 1.337 0.929 1.000 0.579 CA 1.697 20 residues pruned to eliminate duplicates Z: 8 23.087 2.168 0.820 0.847 1.000 0.571 CB 1.642 8 residues pruned to eliminate duplicates Z: 25 55.872 2.418 1.281 0.880 0.958 0.833 CA 1.563 25 residues pruned to eliminate duplicates Z: 20 28.928 2.325 1.271 0.476 0.789 0.526 CA 1.631 19 residues pruned to eliminate duplicates Z: 25 43.858 2.304 0.608 0.910 1.000 0.833 CA 1.714 25 residues pruned to eliminate duplicates Z: 13 18.368 1.860 0.725 0.807 0.917 0.500 CA 1.380 Z: 19 29.203 2.225 0.910 0.879 0.944 0.556 CA 1.244 19 residues pruned to eliminate duplicates Z: 16 17.585 2.029 0.916 0.454 0.867 0.533 CB 1.412 Z: 12 26.552 2.008 0.897 0.864 1.000 0.727 CA 1.541 11 residues pruned to eliminate duplicates Z: 15 5.436 1.882 0.826 0.240 0.643 0.357 CB 0.889 11 residues pruned to eliminate duplicates Z: 6 9.573 2.130 0.825 0.487 0.800 0.600 CB 1.396 Z: 8 18.452 2.090 0.723 0.886 0.857 0.857 CB 1.631 9 residues pruned to eliminate duplicates Z: 9 21.400 1.960 1.163 0.843 1.000 0.750 CB 1.329 8 residues pruned to eliminate duplicates Z: 24 45.913 2.371 1.382 0.872 0.870 0.304 CB 1.421 26 residues pruned to eliminate duplicates Z: 10 16.870 1.961 0.921 0.854 0.889 0.667 CA 1.240 10 residues pruned to eliminate duplicates Z: 20 50.764 2.240 1.213 0.925 1.000 0.684 CA 1.648 20 residues pruned to eliminate duplicates Z: 17 34.485 2.008 1.089 0.919 1.000 0.875 CB 1.448 Z: 6 4.229 1.392 1.090 0.500 0.800 0.400 N 0.812 Z: 18 24.971 1.931 0.812 0.912 1.000 0.765 CB 1.226 16 residues pruned to eliminate duplicates Z: 6 9.054 1.652 0.585 0.605 1.000 0.800 N 1.399 6 residues pruned to eliminate duplicates Z: 26 46.608 2.277 1.132 0.853 0.920 0.720 CA 1.543 26 residues pruned to eliminate duplicates Z: 24 52.208 2.422 1.053 0.920 1.000 0.826 CA 1.541 25 residues pruned to eliminate duplicates Z: 11 18.272 1.897 0.924 0.895 1.000 0.800 CA 1.135 10 residues pruned to eliminate duplicates Z: 12 11.975 2.070 0.432 0.546 0.727 0.636 CA 1.602 10 residues pruned to eliminate duplicates Z: 11 17.218 2.020 0.509 0.891 1.000 0.600 CA 1.283 11 residues pruned to eliminate duplicates Z: 21 40.454 2.084 1.166 0.913 0.950 0.850 CA 1.493 21 residues pruned to eliminate duplicates Z: 20 32.142 1.979 0.816 0.874 1.000 0.789 CA 1.493 19 residues pruned to eliminate duplicates Z: 20 57.570 2.252 1.467 0.919 0.895 0.737 CA 1.873 20 residues pruned to eliminate duplicates Z: 10 14.722 1.847 0.900 0.860 1.000 1.000 CA 1.028 Z: 20 22.323 2.132 1.190 0.420 0.789 0.526 CA 1.510 20 residues pruned to eliminate duplicates Z: 9 19.637 2.168 0.846 0.820 1.000 0.750 CA 1.314 9 residues pruned to eliminate duplicates Z: 26 14.745 1.910 0.694 0.369 0.760 0.480 CB 1.380 Z: 22 56.843 2.177 1.480 0.856 1.000 0.476 CB 1.695 22 residues pruned to eliminate duplicates Z: 12 23.172 1.940 0.873 0.903 1.000 0.818 CA 1.370 12 residues pruned to eliminate duplicates Z: 31 31.811 2.099 1.349 0.404 0.833 0.500 CA 1.563 15 residues pruned to eliminate duplicates Z: 12 27.296 1.813 1.102 0.912 1.000 0.818 CB 1.530 Z: 21 28.451 2.031 0.627 0.865 0.950 0.800 CB 1.484 30 residues pruned to eliminate duplicates Z: 15 23.621 2.231 0.649 0.893 1.000 0.786 CA 1.232 15 residues pruned to eliminate duplicates Z: 6 6.017 1.614 0.275 0.775 0.800 0.400 N 1.282 Z: 20 43.215 2.145 1.408 0.869 0.895 0.684 CA 1.568 20 residues pruned to eliminate duplicates Z: 10 13.797 1.795 0.768 0.667 0.889 0.778 CB 1.397 9 residues pruned to eliminate duplicates Z: 13 10.816 1.825 0.499 0.356 0.917 0.583 CA 1.454 Z: 8 23.219 2.313 1.002 0.891 0.857 0.571 CB 1.589 Z: 16 13.587 2.148 0.826 0.480 0.933 0.733 CB 0.978 16 residues pruned to eliminate duplicates Z: 33 37.787 2.183 0.978 0.656 0.875 0.688 CB 1.530 Z: 26 47.288 2.335 1.154 0.848 0.920 0.520 CB 1.517 26 residues pruned to eliminate duplicates Z: 12 17.082 1.992 0.554 0.641 1.000 0.909 N 1.458 Z: 20 28.246 1.974 0.646 0.858 1.000 0.842 CA 1.469 20 residues pruned to eliminate duplicates Z: 20 40.868 2.088 1.056 0.917 1.000 0.789 CA 1.541 20 residues pruned to eliminate duplicates Z: 31 34.942 2.050 0.755 0.692 0.933 0.800 CB 1.593 20 residues pruned to eliminate duplicates Z: 9 21.086 2.120 0.984 0.855 1.000 0.875 CA 1.308 9 residues pruned to eliminate duplicates Z: 9 11.640 1.927 0.501 0.794 0.875 0.875 CA 1.257 10 residues pruned to eliminate duplicates Z: 23 41.844 2.336 0.852 0.907 1.000 0.864 CA 1.467 23 residues pruned to eliminate duplicates Z: 12 24.261 1.919 0.851 0.904 1.000 0.818 CA 1.467 12 residues pruned to eliminate duplicates Z: 6 4.303 1.861 0.658 0.474 0.600 0.600 CB 1.068 6 residues pruned to eliminate duplicates Z: 10 17.640 2.026 0.887 0.896 0.889 0.778 CA 1.240 10 residues pruned to eliminate duplicates Z: 11 27.076 2.135 0.690 0.910 1.000 1.000 CA 1.684 11 residues pruned to eliminate duplicates Z: 22 38.903 2.005 1.220 0.871 0.952 0.571 CA 1.461 19 residues pruned to eliminate duplicates Z: 29 36.043 2.170 0.916 0.747 0.929 0.607 CB 1.416 27 residues pruned to eliminate duplicates Z: 8 12.272 2.112 0.998 0.555 0.714 0.571 CB 1.458 Z: 20 38.101 2.062 0.933 0.888 0.947 0.684 CA 1.667 20 residues pruned to eliminate duplicates Z: 23 25.998 2.246 1.046 0.508 1.000 0.591 CB 1.196 7 residues pruned to eliminate duplicates Z: 25 26.940 2.115 1.014 0.560 0.875 0.542 CB 1.392 10 residues pruned to eliminate duplicates Z: 24 65.909 2.462 1.321 0.947 0.957 0.783 CA 1.737 24 residues pruned to eliminate duplicates Z: 8 12.266 1.971 0.600 0.830 0.857 0.857 CA 1.289 8 residues pruned to eliminate duplicates Z: 27 47.611 2.373 0.849 0.871 0.962 0.885 CA 1.615 27 residues pruned to eliminate duplicates Z: 10 17.857 1.841 0.924 0.713 0.889 0.556 CA 1.559 10 residues pruned to eliminate duplicates Z: 33 36.206 2.137 0.783 0.692 0.875 0.531 CB 1.610 33 residues pruned to eliminate duplicates Z: 8 19.215 2.177 0.668 0.859 0.857 0.857 CA 1.717 8 residues pruned to eliminate duplicates Z: 10 16.628 2.048 1.233 0.736 0.667 0.333 CB 1.470 9 residues pruned to eliminate duplicates Z: 23 41.191 2.405 0.791 0.930 0.909 0.818 CA 1.569 23 residues pruned to eliminate duplicates Z: 15 19.748 2.022 1.065 0.493 0.929 0.643 CB 1.371 15 residues pruned to eliminate duplicates Z: 22 13.576 2.052 0.730 0.337 0.762 0.429 CB 1.309 9 residues pruned to eliminate duplicates Z: 21 52.036 2.188 1.405 0.861 0.900 0.450 CB 1.806 21 residues pruned to eliminate duplicates Z: 8 18.156 2.053 0.652 0.841 1.000 0.714 CA 1.509 Z: 23 45.365 2.408 0.771 0.910 1.000 0.864 CA 1.609 23 residues pruned to eliminate duplicates Z: 21 29.494 2.063 0.794 0.872 0.900 0.750 CA 1.443 22 residues pruned to eliminate duplicates Z: 6 13.807 1.956 0.506 0.833 1.000 1.000 CB 1.572 Z: 20 32.957 2.118 0.908 0.861 1.000 0.737 CA 1.375 20 residues pruned to eliminate duplicates Z: 18 23.813 1.958 0.967 0.892 0.941 0.471 CB 1.144 18 residues pruned to eliminate duplicates Z: 9 27.942 2.002 1.303 0.907 1.000 0.750 CA 1.522 9 residues pruned to eliminate duplicates Z: 26 33.504 2.072 0.912 0.845 0.880 0.720 CA 1.428 26 residues pruned to eliminate duplicates Z: 49 26.730 2.160 0.632 0.440 0.896 0.583 CB 1.299 16 residues pruned to eliminate duplicates Z: 7 13.230 1.924 1.244 0.500 0.833 0.833 O 1.502 Z: 9 13.710 1.920 0.617 0.812 0.875 0.375 N 1.359 9 residues pruned to eliminate duplicates Z: 11 23.971 2.037 1.080 0.871 0.900 0.700 CB 1.450 11 residues pruned to eliminate duplicates Z: 20 39.199 2.125 1.096 0.883 0.947 0.579 CA 1.541 20 residues pruned to eliminate duplicates Z: 21 37.027 1.953 1.229 0.868 1.000 0.750 CA 1.390 13 residues pruned to eliminate duplicates Z: 26 36.200 2.224 1.479 0.454 0.840 0.480 CB 1.639 21 residues pruned to eliminate duplicates Z: 20 31.295 1.965 0.946 0.898 1.000 0.579 CA 1.343 20 residues pruned to eliminate duplicates Z: 21 52.749 2.154 1.330 0.938 1.000 0.750 CA 1.634 21 residues pruned to eliminate duplicates Z: 19 30.398 2.101 1.364 0.911 0.944 0.722 CB 1.083 19 residues pruned to eliminate duplicates Z: 25 51.047 2.205 1.610 0.872 0.875 0.583 CA 1.508 25 residues pruned to eliminate duplicates Z: 47 52.537 2.274 1.187 0.619 0.891 0.717 CB 1.561 34 residues pruned to eliminate duplicates Z: 6 3.306 1.828 1.045 0.299 0.800 0.400 CB 0.619 Z: 20 31.382 1.952 0.803 0.835 1.000 0.737 CB 1.532 20 residues pruned to eliminate duplicates Z: 6 12.628 1.954 1.015 0.618 1.000 0.600 CB 1.283 6 residues pruned to eliminate duplicates Z: 20 36.379 2.082 0.968 0.875 1.000 0.684 CA 1.481 20 residues pruned to eliminate duplicates Z: 20 55.991 2.274 1.306 0.916 1.000 0.737 CA 1.729 20 residues pruned to eliminate duplicates Z: 20 23.410 1.840 1.037 0.817 0.895 0.737 CB 1.216 Z: 47 35.158 2.216 0.860 0.437 0.935 0.587 CB 1.437 55 residues pruned to eliminate duplicates Z: 9 23.686 2.154 1.205 0.882 0.875 0.750 CA 1.458 10 residues pruned to eliminate duplicates Z: 12 16.375 1.910 0.769 0.814 0.909 0.636 CB 1.223 12 residues pruned to eliminate duplicates Z: 17 28.059 1.975 1.014 0.898 1.000 0.688 CB 1.261 19 residues pruned to eliminate duplicates Z: 38 32.790 2.050 0.904 0.504 0.892 0.703 CB 1.542 26 residues pruned to eliminate duplicates Z: 20 34.975 2.015 0.916 0.876 0.947 0.632 CA 1.595 20 residues pruned to eliminate duplicates Z: 6 11.324 2.217 0.504 0.798 0.800 0.800 CB 1.463 6 residues pruned to eliminate duplicates Z: 30 40.421 1.923 1.046 0.898 0.966 0.655 CA 1.414 32 residues pruned to eliminate duplicates Z: 16 31.536 2.317 0.786 0.933 1.000 0.667 CA 1.374 16 residues pruned to eliminate duplicates Z: 15 15.091 1.892 0.596 0.859 0.857 0.786 CB 1.146 15 residues pruned to eliminate duplicates Z: 8 7.479 1.982 0.545 0.395 0.857 0.571 CB 1.203 Z: 33 42.014 2.263 1.278 0.698 0.906 0.500 CB 1.327 33 residues pruned to eliminate duplicates Z: 21 37.822 2.002 1.082 0.892 1.000 0.800 CA 1.457 21 residues pruned to eliminate duplicates Z: 18 25.356 2.143 1.253 0.763 0.882 0.353 CB 1.143 18 residues pruned to eliminate duplicates Z: 9 13.866 2.029 1.292 0.845 0.875 0.875 CA 0.896 10 residues pruned to eliminate duplicates Z: 9 18.461 2.133 0.636 0.819 1.000 0.750 CA 1.418 9 residues pruned to eliminate duplicates Z: 19 26.224 2.128 0.707 0.939 0.944 0.944 CA 1.252 19 residues pruned to eliminate duplicates Z: 18 33.287 2.194 1.235 0.844 0.824 0.529 CB 1.488 18 residues pruned to eliminate duplicates Z: 9 20.103 1.956 0.972 0.832 1.000 0.750 CA 1.384 8 residues pruned to eliminate duplicates Z: 18 40.174 2.160 1.501 0.875 0.941 0.588 CB 1.394 18 residues pruned to eliminate duplicates Z: 19 29.301 2.124 0.651 0.910 0.944 0.944 CB 1.480 19 residues pruned to eliminate duplicates Z: 15 25.005 1.953 1.041 0.883 0.929 0.714 CA 1.306 15 residues pruned to eliminate duplicates Z: 35 42.746 2.190 0.977 0.662 0.941 0.588 CB 1.548 33 residues pruned to eliminate duplicates Z: 11 17.623 2.135 0.491 0.812 0.900 0.600 CA 1.482 11 residues pruned to eliminate duplicates Z: 21 32.665 2.023 0.825 0.891 0.950 0.850 CA 1.497 21 residues pruned to eliminate duplicates Z: 20 37.452 2.144 0.987 0.924 1.000 0.737 CA 1.417 22 residues pruned to eliminate duplicates Z: 25 44.819 2.305 1.114 0.860 0.875 0.583 CB 1.578 25 residues pruned to eliminate duplicates Z: 14 17.184 1.863 1.015 0.777 0.846 0.615 CA 1.175 13 residues pruned to eliminate duplicates Z: 13 28.232 2.261 0.993 0.911 0.917 0.833 CA 1.398 13 residues pruned to eliminate duplicates Z: 8 8.659 1.870 0.405 0.518 0.857 0.429 N 1.427 8 residues pruned to eliminate duplicates Z: 20 32.012 1.944 1.066 0.871 1.000 0.526 CB 1.334 20 residues pruned to eliminate duplicates Z: 8 28.783 2.190 1.331 0.867 1.000 0.429 CA 1.559 8 residues pruned to eliminate duplicates Z: 18 28.789 2.193 0.818 0.900 1.000 0.882 CA 1.251 18 residues pruned to eliminate duplicates Z: 20 44.605 2.251 0.974 0.938 1.000 0.947 CA 1.602 20 residues pruned to eliminate duplicates Z: 35 51.890 2.264 1.376 0.677 0.912 0.471 CA 1.542 29 residues pruned to eliminate duplicates Z: 20 29.860 1.962 0.738 0.882 1.000 0.789 CB 1.453 20 residues pruned to eliminate duplicates Z: 26 21.592 1.904 0.965 0.674 0.840 0.560 CB 1.170 21 residues pruned to eliminate duplicates Z: 9 8.964 1.635 0.385 0.793 0.875 0.500 O 1.237 Z: 24 54.993 2.402 1.092 0.924 0.957 0.739 CA 1.676 24 residues pruned to eliminate duplicates Z: 11 14.368 2.229 0.267 0.920 1.000 1.000 CA 1.133 11 residues pruned to eliminate duplicates Z: 7 5.141 1.628 1.486 0.448 0.667 0.500 CA 0.821 Z: 10 18.621 2.004 0.858 0.853 0.889 0.778 CA 1.386 10 residues pruned to eliminate duplicates Z: 24 36.885 2.390 0.629 0.906 0.913 0.870 CA 1.538 24 residues pruned to eliminate duplicates Z: 19 35.389 2.053 1.023 0.927 1.000 0.833 CA 1.408 Z: 24 66.328 2.403 1.415 0.861 1.000 0.522 CB 1.751 23 residues pruned to eliminate duplicates Z: 19 27.194 2.217 0.881 0.867 0.889 0.889 CA 1.265 19 residues pruned to eliminate duplicates Z: 32 27.041 2.322 0.768 0.425 0.935 0.548 CB 1.367 32 residues pruned to eliminate duplicates Z: 15 11.190 2.013 0.821 0.367 0.643 0.643 CA 1.464 15 residues pruned to eliminate duplicates Z: 18 32.452 1.994 1.021 0.886 0.941 0.882 CA 1.496 19 residues pruned to eliminate duplicates Z: 8 21.413 2.166 1.375 0.550 0.857 0.857 N 1.748 8 residues pruned to eliminate duplicates Z: 11 20.018 2.086 0.583 0.883 0.900 0.900 CB 1.540 10 residues pruned to eliminate duplicates Z: 21 16.438 2.022 0.930 0.287 0.800 0.550 CB 1.496 Z: 9 10.147 1.752 0.758 0.621 0.750 0.500 N 1.386 Z: 12 16.529 1.841 0.397 0.868 1.000 0.909 CB 1.417 12 residues pruned to eliminate duplicates Z: 23 54.958 2.368 1.165 0.888 1.000 0.727 CB 1.646 23 residues pruned to eliminate duplicates Z: 10 28.591 2.012 1.356 0.851 1.000 0.556 CA 1.487 10 residues pruned to eliminate duplicates Z: 12 21.119 1.839 0.739 0.855 1.000 0.636 CA 1.470 Z: 25 24.910 2.135 0.740 0.478 0.958 0.542 CA 1.460 25 residues pruned to eliminate duplicates Z: 8 19.330 1.998 0.807 0.840 1.000 1.000 CA 1.511 9 residues pruned to eliminate duplicates Z: 12 7.714 1.948 0.357 0.311 0.727 0.636 CB 1.492 12 residues pruned to eliminate duplicates Z: 22 25.143 1.822 1.190 0.822 0.905 0.524 CB 1.150 22 residues pruned to eliminate duplicates Z: 10 13.994 1.990 1.176 0.700 0.778 0.333 CB 1.154 10 residues pruned to eliminate duplicates Z: 20 42.792 2.180 0.983 0.922 1.000 0.632 CA 1.598 20 residues pruned to eliminate duplicates Z: 25 39.652 2.301 0.796 0.860 0.917 0.792 CB 1.571 25 residues pruned to eliminate duplicates Z: 12 23.081 1.995 0.643 0.880 1.000 0.818 CB 1.539 12 residues pruned to eliminate duplicates Z: 20 31.652 1.927 0.990 0.903 1.000 0.579 CB 1.350 20 residues pruned to eliminate duplicates Z: 19 32.753 1.972 0.914 0.918 1.000 0.833 CA 1.442 18 residues pruned to eliminate duplicates Z: 25 60.214 2.310 1.586 0.854 0.917 0.500 CA 1.658 25 residues pruned to eliminate duplicates Z: 19 33.688 2.168 1.208 0.931 0.944 0.556 CB 1.227 18 residues pruned to eliminate duplicates Z: 11 12.000 1.829 0.819 0.401 0.900 0.500 CB 1.407 10 residues pruned to eliminate duplicates Z: 34 22.245 2.000 0.643 0.464 0.970 0.576 CB 1.260 8 residues pruned to eliminate duplicates Z: 8 12.289 1.918 0.577 0.689 0.857 0.714 CB 1.507 Z: 18 35.963 2.200 1.090 0.874 0.941 0.529 CB 1.466 18 residues pruned to eliminate duplicates Z: 14 43.818 2.237 1.559 0.924 0.923 0.615 CB 1.615 15 residues pruned to eliminate duplicates Z: 11 25.431 1.918 1.213 0.908 1.000 1.000 CB 1.346 11 residues pruned to eliminate duplicates Z: 19 37.134 2.094 1.267 0.894 0.944 0.556 CA 1.401 19 residues pruned to eliminate duplicates Z: 20 44.720 2.232 1.287 0.925 1.000 0.789 CA 1.410 20 residues pruned to eliminate duplicates Z: 11 15.026 1.938 0.760 0.580 1.000 0.900 CA 1.291 5 residues pruned to eliminate duplicates Z: 6 4.634 1.731 0.416 0.405 0.800 0.600 N 1.167 6 residues pruned to eliminate duplicates Z: 7 8.603 1.429 0.939 0.749 1.000 0.667 N 1.015 7 residues pruned to eliminate duplicates Z: 9 12.685 1.931 0.374 0.779 0.875 0.625 CA 1.510 9 residues pruned to eliminate duplicates Z: 13 23.449 1.908 0.859 0.829 0.917 0.583 CA 1.567 13 residues pruned to eliminate duplicates Z: 9 17.528 1.982 1.403 0.834 0.875 0.750 CA 1.115 9 residues pruned to eliminate duplicates Z: 20 29.242 2.008 0.788 0.859 0.947 0.789 CA 1.452 20 residues pruned to eliminate duplicates Z: 8 19.168 2.091 1.209 0.854 0.714 0.571 CA 1.623 8 residues pruned to eliminate duplicates Z: 11 17.922 2.077 1.252 0.748 0.700 0.500 CB 1.387 11 residues pruned to eliminate duplicates Z: 9 15.771 2.188 0.644 0.611 0.875 0.750 CA 1.595 7 residues pruned to eliminate duplicates Z: 19 29.270 1.910 0.966 0.829 1.000 0.667 CB 1.383 Z: 8 18.847 2.115 0.961 0.859 1.000 1.000 CB 1.264 8 residues pruned to eliminate duplicates Z: 8 13.987 1.950 0.428 0.888 1.000 0.857 N 1.367 8 residues pruned to eliminate duplicates Z: 24 51.629 2.317 1.189 0.896 1.000 0.522 CB 1.521 24 residues pruned to eliminate duplicates Z: 20 28.116 1.962 0.866 0.829 0.947 0.684 CB 1.399 20 residues pruned to eliminate duplicates Z: 7 14.473 2.119 0.691 0.824 0.833 0.667 CA 1.494 7 residues pruned to eliminate duplicates Z: 24 45.607 2.353 1.082 0.875 0.957 0.696 CA 1.476 24 residues pruned to eliminate duplicates Z: 11 12.745 1.929 1.026 0.770 0.800 0.500 CB 1.015 11 residues pruned to eliminate duplicates Z: 12 13.557 2.063 0.366 0.555 0.909 0.636 CA 1.511 12 residues pruned to eliminate duplicates Z: 10 17.093 1.934 0.798 0.881 0.889 0.556 CA 1.335 10 residues pruned to eliminate duplicates Z: 10 10.888 1.876 0.687 0.672 0.778 0.667 CB 1.258 10 residues pruned to eliminate duplicates Z: 24 62.328 2.455 1.283 0.926 0.913 0.870 CB 1.780 23 residues pruned to eliminate duplicates Z: 7 7.597 1.947 0.337 0.602 0.833 0.667 CB 1.297 Z: 7 9.724 1.951 0.451 0.523 1.000 0.667 CA 1.371 7 residues pruned to eliminate duplicates Z: 20 24.653 2.001 0.492 0.868 1.000 0.789 CA 1.384 20 residues pruned to eliminate duplicates Z: 9 22.190 2.243 0.934 0.857 1.000 0.750 CA 1.332 9 residues pruned to eliminate duplicates Z: 6 9.956 1.897 1.276 0.681 0.800 0.800 CB 1.091 Z: 7 4.447 1.673 0.510 0.524 0.833 0.500 CB 0.843 Z: 10 29.230 1.982 1.532 0.859 1.000 0.556 CB 1.429 9 residues pruned to eliminate duplicates Z: 21 33.702 2.002 0.956 0.902 0.950 0.700 CA 1.445 19 residues pruned to eliminate duplicates Z: 22 39.147 2.250 1.092 0.670 1.000 0.619 CA 1.552 19 residues pruned to eliminate duplicates Z: 18 21.972 2.082 0.775 0.891 0.765 0.529 CA 1.356 18 residues pruned to eliminate duplicates Z: 18 29.883 2.260 0.861 0.898 1.000 0.824 CA 1.233 18 residues pruned to eliminate duplicates Z: 20 32.580 2.113 1.154 0.893 0.895 0.684 CA 1.317 20 residues pruned to eliminate duplicates Z: 34 19.653 2.057 0.472 0.401 0.970 0.515 CB 1.294 6 residues pruned to eliminate duplicates Z: 6 4.504 1.748 0.734 0.545 0.600 0.400 CB 1.060 Z: 29 49.068 2.088 1.374 0.849 0.929 0.393 CB 1.493 27 residues pruned to eliminate duplicates Z: 13 29.433 2.285 0.581 0.848 0.917 0.750 CB 1.903 13 residues pruned to eliminate duplicates Z: 6 5.953 1.932 0.806 0.385 0.800 0.600 CB 1.078 Z: 12 8.564 1.471 0.833 0.436 0.909 0.545 N 1.125 Z: 25 54.912 2.385 1.213 0.899 0.917 0.708 CA 1.656 25 residues pruned to eliminate duplicates Z: 7 13.480 1.976 0.530 0.875 1.000 0.833 CA 1.324 7 residues pruned to eliminate duplicates Z: 21 31.748 2.024 0.905 0.884 0.900 0.750 CB 1.478 22 residues pruned to eliminate duplicates Z: 6 3.116 1.258 1.018 0.602 0.800 0.800 N 0.623 Z: 10 27.624 2.145 1.122 0.901 1.000 0.889 CA 1.444 22 residues pruned to eliminate duplicates Z: 9 11.492 1.880 1.165 0.704 0.750 0.500 CA 1.105 10 residues pruned to eliminate duplicates Z: 7 3.916 1.777 0.438 0.328 0.667 0.500 CB 1.133 Z: 9 16.482 1.905 1.520 0.726 0.875 0.500 CB 1.132 9 residues pruned to eliminate duplicates Z: 21 27.113 1.794 0.868 0.852 1.000 0.650 CB 1.338 20 residues pruned to eliminate duplicates Z: 26 45.408 2.312 0.908 0.929 1.000 0.880 CA 1.440 26 residues pruned to eliminate duplicates Z: 16 11.025 2.197 1.014 0.429 0.800 0.533 CB 0.865 16 residues pruned to eliminate duplicates Z: 9 18.865 1.952 1.164 0.469 1.000 0.625 CA 1.629 Z: 19 25.999 1.860 0.622 0.890 0.944 0.722 N 1.547 Z: 54 44.796 2.226 0.973 0.525 0.906 0.566 CA 1.508 55 residues pruned to eliminate duplicates Z: 9 9.278 1.952 0.723 0.361 0.875 0.625 CA 1.295 9 residues pruned to eliminate duplicates Z: 21 32.434 1.991 0.911 0.903 0.950 0.800 CA 1.430 21 residues pruned to eliminate duplicates Z: 16 41.696 2.225 1.332 0.905 0.867 0.533 CB 1.704 16 residues pruned to eliminate duplicates Z: 18 39.154 2.040 1.308 0.932 1.000 0.765 CB 1.409 19 residues pruned to eliminate duplicates Z: 24 61.371 2.220 1.465 0.924 1.000 0.739 CA 1.643 26 residues pruned to eliminate duplicates 6 1.653 1.562 0.215 0.100 0.600 0.400 CB 1.082 ? Z: 15 21.412 1.853 0.794 0.828 0.857 0.857 N 1.513 15 residues pruned to eliminate duplicates Z: 8 5.021 1.841 0.646 0.333 0.714 0.429 CB 1.052 Z: 25 34.182 2.189 0.961 0.847 0.917 0.708 CA 1.316 25 residues pruned to eliminate duplicates Z: 9 18.314 1.872 1.278 0.859 0.750 0.500 CA 1.490 9 residues pruned to eliminate duplicates Z: 25 37.538 2.250 0.973 0.915 1.000 0.917 CA 1.220 25 residues pruned to eliminate duplicates Z: 30 36.055 2.279 1.299 0.447 0.828 0.655 CB 1.630 18 residues pruned to eliminate duplicates Z: 8 2.308 1.720 0.724 0.218 0.571 0.286 CB 0.717 8 residues pruned to eliminate duplicates Z: 20 29.678 2.063 0.868 0.909 1.000 0.895 CA 1.254 20 residues pruned to eliminate duplicates Z: 18 41.978 2.317 1.467 0.896 0.941 0.588 CA 1.355 18 residues pruned to eliminate duplicates Z: 18 37.609 2.289 0.973 0.930 0.882 0.529 CA 1.601 18 residues pruned to eliminate duplicates Z: 6 6.164 2.082 0.535 0.773 0.800 0.600 CB 0.847 Z: 19 42.487 2.280 1.011 0.922 1.000 0.833 CA 1.536 19 residues pruned to eliminate duplicates Z: 11 31.559 2.328 1.071 0.890 1.000 0.900 CB 1.489 11 residues pruned to eliminate duplicates Z: 12 8.475 1.676 0.402 0.653 0.909 0.545 CB 1.038 12 residues pruned to eliminate duplicates Z: 12 26.452 1.872 1.018 0.884 1.000 0.818 CA 1.525 12 residues pruned to eliminate duplicates Z: 7 13.312 1.663 1.366 0.721 1.000 0.667 CB 1.132 7 residues pruned to eliminate duplicates Z: 8 7.908 1.696 1.180 0.317 1.000 0.714 CB 0.989 Z: 17 16.267 2.027 0.549 0.464 0.875 0.562 CA 1.535 17 residues pruned to eliminate duplicates Z: 26 34.452 2.143 0.858 0.733 0.920 0.720 CA 1.526 26 residues pruned to eliminate duplicates Z: 33 15.872 1.978 0.511 0.404 0.812 0.438 CB 1.278 34 residues pruned to eliminate duplicates Z: 28 28.101 1.935 0.978 0.788 0.778 0.370 CB 1.410 30 residues pruned to eliminate duplicates Z: 9 19.006 2.184 0.892 0.691 1.000 0.750 CA 1.366 9 residues pruned to eliminate duplicates Z: 20 28.031 1.873 1.067 0.856 0.947 0.526 CA 1.293 20 residues pruned to eliminate duplicates Z: 34 34.309 2.106 1.093 0.578 0.848 0.606 CB 1.482 17 residues pruned to eliminate duplicates Z: 10 11.369 2.031 1.114 0.418 0.778 0.333 CA 1.235 10 residues pruned to eliminate duplicates Z: 47 45.968 2.162 0.958 0.587 0.935 0.630 CB 1.574 35 residues pruned to eliminate duplicates Z: 24 62.417 2.276 1.617 0.900 0.957 0.652 CA 1.632 24 residues pruned to eliminate duplicates Z: 24 24.728 2.024 1.055 0.458 0.913 0.565 CB 1.416 24 residues pruned to eliminate duplicates Z: 18 24.272 1.891 0.726 0.899 0.941 0.824 CB 1.370 18 residues pruned to eliminate duplicates Z: 12 21.077 1.922 0.875 0.807 0.909 0.636 CA 1.484 12 residues pruned to eliminate duplicates Z: 21 28.639 1.989 0.681 0.881 1.000 0.950 CA 1.387 21 residues pruned to eliminate duplicates Z: 21 36.438 1.984 1.099 0.880 0.950 0.700 CA 1.492 21 residues pruned to eliminate duplicates Z: 9 11.765 1.958 0.649 0.837 0.875 0.375 CB 1.101 9 residues pruned to eliminate duplicates Z: 24 55.607 2.410 1.263 0.915 0.957 0.783 CA 1.570 24 residues pruned to eliminate duplicates Z: 8 19.382 2.007 1.200 0.798 0.857 0.429 CA 1.492 10 residues pruned to eliminate duplicates Z: 9 21.304 2.083 1.303 0.796 0.875 0.625 CB 1.385 10 residues pruned to eliminate duplicates Z: 8 31.305 2.199 1.411 0.824 1.000 0.429 CA 1.685 10 residues pruned to eliminate duplicates Z: 16 11.236 1.946 0.497 0.355 0.933 0.667 CB 1.248 Z: 28 11.010 1.682 0.450 0.303 0.926 0.519 CB 1.168 7 residues pruned to eliminate duplicates Z: 9 12.373 2.021 0.402 0.600 1.000 0.625 CB 1.404 9 residues pruned to eliminate duplicates Z: 7 6.024 2.110 0.566 0.245 0.667 0.500 CA 1.499 7 residues pruned to eliminate duplicates Z: 32 25.515 2.137 0.821 0.483 0.871 0.516 CA 1.377 32 residues pruned to eliminate duplicates Z: 6 4.496 1.871 0.640 0.746 1.000 0.600 CB 0.526 6 residues pruned to eliminate duplicates Z: 20 24.301 2.194 0.598 0.896 1.000 0.895 CA 1.139 20 residues pruned to eliminate duplicates Z: 19 37.130 2.137 1.050 0.907 0.944 0.778 CB 1.503 19 residues pruned to eliminate duplicates Z: 35 32.930 2.120 0.804 0.668 0.882 0.647 CB 1.432 33 residues pruned to eliminate duplicates Z: 10 22.985 2.068 0.647 0.897 1.000 0.778 CB 1.611 10 residues pruned to eliminate duplicates Z: 12 17.474 1.820 0.922 0.833 0.818 0.545 CA 1.381 12 residues pruned to eliminate duplicates Z: 38 28.957 2.253 0.702 0.468 0.946 0.676 CB 1.356 38 residues pruned to eliminate duplicates Z: 6 8.410 1.698 0.549 0.806 1.000 1.000 CA 1.096 6 residues pruned to eliminate duplicates Z: 25 46.983 2.342 0.822 0.879 1.000 0.833 CA 1.630 25 residues pruned to eliminate duplicates Z: 17 29.787 2.199 0.922 0.920 0.938 0.812 CA 1.323 17 residues pruned to eliminate duplicates Z: 6 14.443 1.802 1.036 0.742 1.000 0.400 CA 1.418 6 residues pruned to eliminate duplicates Z: 20 42.660 2.191 1.229 0.893 0.947 0.737 CA 1.519 20 residues pruned to eliminate duplicates Z: 10 4.634 1.819 0.454 0.335 0.889 0.556 CB 0.786 Z: 18 29.913 1.917 1.029 0.885 1.000 0.706 CB 1.346 19 residues pruned to eliminate duplicates Z: 20 34.333 2.233 0.706 0.916 1.000 0.947 CA 1.461 20 residues pruned to eliminate duplicates Z: 11 21.915 1.960 1.002 0.883 0.900 0.700 CB 1.419 11 residues pruned to eliminate duplicates Z: 38 33.370 2.106 0.946 0.546 0.865 0.649 CA 1.479 38 residues pruned to eliminate duplicates Z: 9 28.529 2.125 1.296 0.870 1.000 0.875 CA 1.509 9 residues pruned to eliminate duplicates Z: 10 35.535 2.124 1.376 0.903 1.000 0.778 CA 1.673 11 residues pruned to eliminate duplicates Z: 11 13.125 1.897 0.312 0.866 1.000 1.000 CA 1.221 Z: 25 32.985 2.295 0.561 0.934 0.958 0.917 CA 1.367 25 residues pruned to eliminate duplicates Z: 28 21.912 2.083 0.558 0.476 0.963 0.704 CB 1.382 32 residues pruned to eliminate duplicates Z: 9 23.904 2.234 1.111 0.827 0.875 0.875 CA 1.543 9 residues pruned to eliminate duplicates Z: 12 22.298 1.934 0.906 0.874 1.000 0.818 CA 1.328 11 residues pruned to eliminate duplicates Z: 12 14.690 2.086 0.621 0.657 0.818 0.818 CA 1.384 12 residues pruned to eliminate duplicates Z: 21 39.244 2.047 1.157 0.906 1.000 0.800 CA 1.413 21 residues pruned to eliminate duplicates Z: 12 11.018 1.708 0.573 0.746 0.818 0.636 CA 1.213 12 residues pruned to eliminate duplicates Z: 10 17.923 1.827 1.391 0.741 0.889 0.444 CB 1.240 Z: 13 18.914 2.058 0.870 0.595 0.833 0.750 CA 1.555 13 residues pruned to eliminate duplicates Z: 24 70.205 2.316 1.684 0.945 1.000 0.609 CA 1.629 24 residues pruned to eliminate duplicates Z: 19 23.548 2.056 0.582 0.654 1.000 0.611 CB 1.480 19 residues pruned to eliminate duplicates Z: 26 22.668 1.886 0.908 0.451 0.880 0.600 CA 1.506 6 residues pruned to eliminate duplicates Z: 12 22.451 1.957 0.993 0.916 0.909 0.818 CB 1.348 12 residues pruned to eliminate duplicates Z: 6 2.042 1.970 0.165 0.214 0.600 0.200 N 0.929 Z: 27 17.719 1.985 0.788 0.611 0.885 0.538 CB 0.996 27 residues pruned to eliminate duplicates Z: 9 18.572 2.060 1.161 0.870 1.000 1.000 CA 1.076 9 residues pruned to eliminate duplicates Z: 21 28.536 2.094 0.840 0.912 1.000 0.950 CA 1.173 21 residues pruned to eliminate duplicates Z: 12 24.952 2.437 0.645 0.898 0.909 0.909 CA 1.476 12 residues pruned to eliminate duplicates Z: 16 19.414 2.113 1.106 0.558 0.867 0.400 CB 1.228 11 residues pruned to eliminate duplicates Z: 20 29.301 2.017 0.818 0.826 0.947 0.684 CA 1.459 20 residues pruned to eliminate duplicates Z: 23 25.033 2.373 0.683 0.468 0.909 0.636 CB 1.518 23 residues pruned to eliminate duplicates Z: 13 17.065 2.227 0.314 0.907 1.000 1.000 CA 1.196 13 residues pruned to eliminate duplicates Z: 19 30.305 1.865 1.063 0.853 1.000 0.889 CB 1.372 19 residues pruned to eliminate duplicates Z: 21 36.404 1.997 1.002 0.892 1.000 1.000 CA 1.463 21 residues pruned to eliminate duplicates Z: 9 6.177 1.805 0.306 0.358 0.875 0.375 CB 1.234 8 residues pruned to eliminate duplicates Z: 25 52.793 2.343 1.277 0.895 0.917 0.750 CA 1.580 25 residues pruned to eliminate duplicates Z: 24 47.530 2.302 0.865 0.927 0.957 0.826 CA 1.691 24 residues pruned to eliminate duplicates Z: 8 16.244 1.808 0.934 0.741 1.000 0.857 CB 1.415 Z: 19 33.216 2.079 1.159 0.876 0.944 0.556 CA 1.342 18 residues pruned to eliminate duplicates 6 1.750 1.904 0.399 0.688 0.600 0.400 CB 0.412 ? Z: 8 6.803 1.974 0.590 0.353 0.857 0.714 CA 1.120 8 residues pruned to eliminate duplicates Z: 19 30.327 1.921 0.960 0.851 1.000 0.722 CB 1.405 19 residues pruned to eliminate duplicates Z: 15 4.889 1.919 0.230 0.323 0.643 0.500 CB 1.046 Z: 18 42.784 2.220 1.481 0.938 0.882 0.588 CB 1.485 18 residues pruned to eliminate duplicates Z: 6 3.831 1.824 0.207 0.722 0.800 0.600 CB 0.796 6 residues pruned to eliminate duplicates Z: 25 47.646 2.354 1.082 0.911 1.000 0.917 CA 1.406 25 residues pruned to eliminate duplicates Z: 17 12.758 1.983 0.492 0.404 0.750 0.500 CA 1.590 17 residues pruned to eliminate duplicates Z: 21 40.211 2.166 1.047 0.915 1.000 0.900 CA 1.433 21 residues pruned to eliminate duplicates Z: 18 23.676 1.872 0.572 0.862 0.941 0.588 CB 1.522 19 residues pruned to eliminate duplicates Z: 6 6.167 1.930 0.965 0.303 0.800 0.400 CA 1.132 6 residues pruned to eliminate duplicates Z: 12 23.679 2.009 0.698 0.884 1.000 0.636 CA 1.512 12 residues pruned to eliminate duplicates Z: 21 32.083 2.021 0.984 0.877 1.000 0.700 CB 1.299 21 residues pruned to eliminate duplicates Z: 9 14.610 2.214 1.000 0.426 0.875 0.750 CB 1.440 9 residues pruned to eliminate duplicates Z: 12 18.101 1.828 0.673 0.852 1.000 0.636 CB 1.320 12 residues pruned to eliminate duplicates Z: 8 11.704 1.929 0.257 0.823 1.000 0.571 CA 1.379 8 residues pruned to eliminate duplicates Z: 20 36.896 2.057 0.968 0.889 1.000 0.842 CA 1.506 20 residues pruned to eliminate duplicates Z: 25 47.339 2.356 1.012 0.876 0.917 0.875 CB 1.616 25 residues pruned to eliminate duplicates Z: 8 11.125 1.940 1.026 0.527 0.857 0.571 CB 1.215 8 residues pruned to eliminate duplicates Z: 7 8.475 1.710 0.369 0.710 1.000 1.000 CB 1.222 Z: 36 31.397 2.048 0.933 0.552 0.857 0.714 CB 1.487 38 residues pruned to eliminate duplicates Z: 51 32.411 2.156 0.951 0.383 0.860 0.560 CB 1.436 51 residues pruned to eliminate duplicates Z: 8 4.792 1.438 0.409 0.643 0.857 0.714 CB 0.912 Z: 19 31.982 1.982 0.961 0.899 0.944 0.833 CA 1.468 19 residues pruned to eliminate duplicates Z: 20 33.684 1.896 1.029 0.825 1.000 0.526 CB 1.516 20 residues pruned to eliminate duplicates Z: 55 40.368 2.123 0.798 0.590 0.889 0.611 CB 1.485 36 residues pruned to eliminate duplicates Z: 16 26.533 1.922 1.143 0.925 0.933 0.600 CB 1.250 21 residues pruned to eliminate duplicates Z: 48 36.397 1.964 0.969 0.598 0.872 0.553 CB 1.434 48 residues pruned to eliminate duplicates Z: 25 45.858 2.258 0.998 0.903 0.958 0.625 CA 1.543 25 residues pruned to eliminate duplicates Z: 46 34.119 2.080 0.871 0.550 0.889 0.467 CB 1.400 42 residues pruned to eliminate duplicates Z: 11 12.011 2.298 0.525 0.325 0.900 0.500 CB 1.461 11 residues pruned to eliminate duplicates Z: 20 27.294 1.920 0.880 0.885 0.947 0.789 CA 1.322 20 residues pruned to eliminate duplicates Z: 7 4.791 1.489 0.351 0.827 1.000 0.500 CA 0.733 7 residues pruned to eliminate duplicates Z: 9 8.487 1.910 0.319 0.614 0.750 0.625 N 1.426 Z: 8 14.605 1.926 0.530 0.801 1.000 0.571 CA 1.440 8 residues pruned to eliminate duplicates Z: 26 23.146 2.101 1.075 0.390 0.840 0.600 CB 1.420 26 residues pruned to eliminate duplicates Z: 7 19.870 2.089 1.088 0.883 1.000 0.833 CA 1.345 7 residues pruned to eliminate duplicates Z: 6 5.191 1.802 0.572 0.439 0.800 0.800 CB 1.090 Z: 18 14.629 1.911 0.757 0.503 0.882 0.706 CB 1.194 18 residues pruned to eliminate duplicates Z: 10 10.219 2.021 0.822 0.343 1.000 0.667 CA 1.098 10 residues pruned to eliminate duplicates Z: 8 10.182 1.673 0.989 0.815 1.000 0.286 CB 0.880 8 residues pruned to eliminate duplicates Z: 21 34.652 1.921 1.168 0.901 0.950 0.650 CA 1.398 21 residues pruned to eliminate duplicates Z: 28 18.757 1.926 0.672 0.480 0.889 0.519 CB 1.288 12 residues pruned to eliminate duplicates Z: 14 10.875 1.873 0.761 0.307 0.846 0.692 CB 1.339 10 residues pruned to eliminate duplicates Z: 26 48.646 2.288 1.185 0.856 0.880 0.720 CA 1.630 26 residues pruned to eliminate duplicates Z: 19 18.682 1.786 0.958 0.748 0.833 0.556 CB 1.211 19 residues pruned to eliminate duplicates Z: 19 36.602 2.177 0.803 0.887 1.000 0.944 CA 1.585 19 residues pruned to eliminate duplicates Z: 10 7.727 1.640 0.313 0.414 0.889 0.556 CA 1.473 10 residues pruned to eliminate duplicates Z: 6 4.105 1.706 0.750 0.376 0.800 0.400 CB 0.878 Z: 9 9.988 1.690 0.813 0.508 1.000 0.625 CB 1.143 11 residues pruned to eliminate duplicates Z: 52 41.759 2.134 0.931 0.587 0.882 0.627 CB 1.480 57 residues pruned to eliminate duplicates Z: 18 32.622 1.996 0.941 0.921 1.000 0.824 CA 1.437 20 residues pruned to eliminate duplicates Z: 12 6.496 1.677 0.880 0.356 0.636 0.545 CA 1.141 12 residues pruned to eliminate duplicates Z: 12 15.287 1.765 0.383 0.821 1.000 0.818 CA 1.430 9 residues pruned to eliminate duplicates Z: 6 3.168 1.858 0.240 0.256 0.600 0.200 O 1.355 Z: 10 9.540 1.618 1.407 0.716 0.667 0.556 CB 1.008 10 residues pruned to eliminate duplicates Z: 6 6.303 1.611 0.332 0.758 1.000 0.800 CA 1.044 6 residues pruned to eliminate duplicates Z: 6 3.858 1.845 -0.068 0.299 1.000 0.800 N 1.256 Z: 10 33.207 1.996 1.596 0.846 1.000 0.778 CB 1.586 10 residues pruned to eliminate duplicates Z: 46 21.691 1.834 0.794 0.397 0.756 0.467 CB 1.449 33 residues pruned to eliminate duplicates Z: 10 19.318 1.752 1.044 0.835 0.889 0.778 CA 1.515 12 residues pruned to eliminate duplicates Z: 19 24.376 2.120 0.818 0.909 0.944 0.722 CA 1.120 19 residues pruned to eliminate duplicates Z: 6 3.535 1.898 0.777 0.134 0.800 0.400 CB 0.923 Z: 20 9.374 1.795 0.459 0.385 0.789 0.421 CB 1.175 Z: 8 3.149 1.854 0.363 0.214 0.571 0.429 N 1.154 Z: 20 40.821 2.082 1.111 0.882 1.000 0.842 CA 1.542 20 residues pruned to eliminate duplicates Z: 15 11.467 1.833 0.497 0.366 0.857 0.286 O 1.504 12 residues pruned to eliminate duplicates Z: 8 5.918 1.756 0.652 0.466 0.714 0.571 CB 1.117 Z: 37 32.287 2.122 0.832 0.653 0.833 0.583 CB 1.441 37 residues pruned to eliminate duplicates Z: 21 26.044 1.808 0.925 0.844 0.900 0.600 CA 1.383 21 residues pruned to eliminate duplicates Z: 11 19.823 1.927 0.795 0.879 0.900 0.700 CB 1.461 9 residues pruned to eliminate duplicates Z: 19 34.420 2.135 0.712 0.915 1.000 0.833 CA 1.569 19 residues pruned to eliminate duplicates Z: 16 10.332 1.910 0.845 0.269 0.800 0.467 CB 1.230 12 residues pruned to eliminate duplicates Z: 13 6.931 1.750 0.605 0.324 0.667 0.417 CB 1.297 Z: 19 38.308 2.122 0.878 0.879 1.000 0.833 CA 1.643 19 residues pruned to eliminate duplicates Z: 36 44.030 2.209 1.341 0.724 0.914 0.571 CB 1.287 33 residues pruned to eliminate duplicates Z: 13 19.681 1.931 0.711 0.862 0.917 0.833 CA 1.377 13 residues pruned to eliminate duplicates Z: 9 13.394 1.801 0.725 0.738 0.875 0.625 O 1.407 9 residues pruned to eliminate duplicates Z: 25 39.394 2.354 0.872 0.884 0.917 0.792 CA 1.438 25 residues pruned to eliminate duplicates Z: 29 31.773 1.932 0.907 0.687 0.964 0.679 CB 1.424 29 residues pruned to eliminate duplicates Z: 9 26.574 2.074 1.160 0.853 1.000 0.750 CA 1.550 9 residues pruned to eliminate duplicates Z: 17 28.736 1.964 1.143 0.904 0.938 0.750 CB 1.297 17 residues pruned to eliminate duplicates Z: 17 8.190 1.739 0.528 0.279 0.812 0.312 CA 1.217 16 residues pruned to eliminate duplicates Z: 16 8.401 1.647 0.915 0.182 0.800 0.400 CB 1.261 Z: 32 21.131 2.221 0.531 0.421 0.839 0.613 CB 1.446 32 residues pruned to eliminate duplicates Z: 19 27.995 2.099 0.697 0.882 0.944 0.611 CA 1.419 19 residues pruned to eliminate duplicates Z: 7 6.509 1.643 0.532 0.249 1.000 0.333 CB 1.409 Z: 20 43.964 2.056 1.221 0.905 1.000 0.789 CA 1.572 20 residues pruned to eliminate duplicates Z: 19 30.927 2.163 1.111 0.890 0.889 0.778 CA 1.292 19 residues pruned to eliminate duplicates Z: 13 11.707 1.865 0.976 0.446 0.667 0.583 N 1.453 26 residues pruned to eliminate duplicates Z: 11 14.188 1.636 1.264 0.865 0.800 0.600 CA 1.110 11 residues pruned to eliminate duplicates Z: 9 10.141 1.807 0.811 0.446 0.750 0.625 CA 1.544 9 residues pruned to eliminate duplicates Z: 10 14.425 1.905 0.684 0.726 1.000 0.889 CB 1.223 Z: 16 11.190 1.969 0.599 0.289 0.800 0.400 CB 1.453 Z: 6 8.673 1.548 0.736 0.761 1.000 0.800 N 1.145 6 residues pruned to eliminate duplicates Z: 33 24.168 1.856 0.783 0.504 0.875 0.562 CB 1.469 38 residues pruned to eliminate duplicates Z: 7 2.122 1.551 0.408 0.313 0.667 0.500 CB 0.732 Z: 17 30.693 2.045 0.977 0.897 0.938 0.812 CA 1.449 17 residues pruned to eliminate duplicates Z: 29 19.019 1.983 0.608 0.428 0.857 0.643 CB 1.417 21 residues pruned to eliminate duplicates Z: 18 47.535 2.097 1.586 0.943 1.000 0.706 CA 1.473 20 residues pruned to eliminate duplicates Z: 46 47.810 2.159 0.981 0.616 0.956 0.622 CB 1.563 46 residues pruned to eliminate duplicates Z: 34 33.906 2.157 0.809 0.689 0.879 0.758 CB 1.447 37 residues pruned to eliminate duplicates Z: 22 29.299 1.795 1.134 0.857 0.952 0.810 CB 1.292 22 residues pruned to eliminate duplicates Z: 20 35.372 2.116 1.033 0.878 0.947 0.684 CA 1.445 20 residues pruned to eliminate duplicates Z: 8 12.365 1.680 0.661 0.804 1.000 0.714 CB 1.285 8 residues pruned to eliminate duplicates Z: 7 5.177 1.493 0.559 0.728 0.833 0.833 C 0.888 7 residues pruned to eliminate duplicates Z: 11 8.857 1.555 0.573 0.816 0.900 0.800 CA 0.967 11 residues pruned to eliminate duplicates Z: 61 30.643 2.019 0.845 0.427 0.867 0.567 CB 1.322 60 residues pruned to eliminate duplicates Z: 20 20.374 2.073 0.876 0.436 0.895 0.737 CA 1.435 20 residues pruned to eliminate duplicates Z: 30 31.294 2.133 0.986 0.519 0.966 0.586 CB 1.394 29 residues pruned to eliminate duplicates Z: 12 20.788 1.940 1.281 0.764 0.818 0.636 CA 1.370 12 residues pruned to eliminate duplicates Z: 19 5.621 1.698 0.299 0.341 0.778 0.333 CB 0.918 Z: 36 33.602 2.070 0.841 0.608 0.857 0.714 CA 1.570 36 residues pruned to eliminate duplicates Z: 11 8.249 1.667 1.097 0.278 0.800 0.500 N 1.199 Z: 13 20.537 1.998 0.773 0.900 0.917 0.750 CA 1.304 13 residues pruned to eliminate duplicates Z: 13 6.469 1.980 0.388 0.378 0.667 0.417 CB 1.161 5 residues pruned to eliminate duplicates Z: 21 29.424 2.016 0.753 0.853 1.000 0.800 CB 1.376 21 residues pruned to eliminate duplicates Z: 23 54.604 2.368 1.133 0.894 1.000 0.818 CB 1.654 23 residues pruned to eliminate duplicates Z: 19 13.509 1.822 0.719 0.392 0.722 0.500 CA 1.577 14 residues pruned to eliminate duplicates Z: 8 10.075 2.087 0.568 0.736 0.857 0.857 CB 1.098 8 residues pruned to eliminate duplicates Z: 8 6.991 1.781 0.382 0.333 0.857 0.286 CB 1.504 Z: 12 13.860 2.140 0.820 0.327 0.909 0.545 CB 1.427 12 residues pruned to eliminate duplicates Z: 19 37.415 2.155 0.939 0.889 0.944 0.778 CA 1.610 19 residues pruned to eliminate duplicates Z: 8 17.435 2.191 0.539 0.803 1.000 0.857 CA 1.500 9 residues pruned to eliminate duplicates Z: 19 34.091 2.189 0.737 0.873 0.944 0.778 CA 1.629 19 residues pruned to eliminate duplicates Z: 10 21.800 1.855 1.113 0.907 1.000 0.667 CB 1.318 10 residues pruned to eliminate duplicates Z: 10 16.750 1.946 0.318 0.856 1.000 0.889 CA 1.605 10 residues pruned to eliminate duplicates Z: 75 40.170 1.995 0.844 0.580 0.878 0.595 CB 1.338 72 residues pruned to eliminate duplicates Z: 19 23.813 2.204 0.774 0.559 0.833 0.667 CB 1.626 19 residues pruned to eliminate duplicates Z: 19 35.905 1.901 1.151 0.919 1.000 0.722 N 1.458 19 residues pruned to eliminate duplicates Z: 11 19.015 1.840 0.746 0.860 1.000 0.700 CA 1.377 11 residues pruned to eliminate duplicates Z: 10 23.571 2.015 0.845 0.898 1.000 0.889 CA 1.512 10 residues pruned to eliminate duplicates Z: 18 28.476 1.963 0.971 0.876 0.882 0.588 CB 1.470 18 residues pruned to eliminate duplicates Z: 6 5.927 1.781 -0.041 0.785 1.000 0.800 CB 1.207 6 residues pruned to eliminate duplicates Z: 40 41.228 2.146 1.136 0.661 0.846 0.538 CB 1.467 40 residues pruned to eliminate duplicates Z: 25 19.144 1.967 0.537 0.694 0.833 0.625 CB 1.300 25 residues pruned to eliminate duplicates Z: 24 40.247 2.340 0.732 0.892 0.957 0.826 CA 1.556 24 residues pruned to eliminate duplicates Z: 19 25.774 1.945 0.997 0.895 0.889 0.667 CB 1.262 18 residues pruned to eliminate duplicates Z: 9 6.011 1.894 0.259 0.302 0.750 0.500 CB 1.482 9 residues pruned to eliminate duplicates Z: 18 26.819 1.930 0.837 0.881 1.000 0.824 CB 1.328 18 residues pruned to eliminate duplicates Z: 19 30.318 1.995 1.211 0.922 0.944 0.667 CB 1.206 20 residues pruned to eliminate duplicates Z: 19 12.240 1.760 0.927 0.321 0.889 0.389 CB 1.165 23 residues pruned to eliminate duplicates Z: 17 42.730 2.303 1.542 0.787 0.875 0.500 CB 1.620 17 residues pruned to eliminate duplicates Z: 7 5.339 1.831 0.997 0.393 0.667 0.500 CB 1.001 Z: 8 8.626 1.725 0.991 0.502 0.857 0.429 CA 1.106 8 residues pruned to eliminate duplicates Z: 26 36.072 2.230 0.889 0.830 0.920 0.640 CA 1.400 26 residues pruned to eliminate duplicates Z: 18 19.856 1.946 0.560 0.867 0.882 0.647 CB 1.315 18 residues pruned to eliminate duplicates Z: 9 19.586 2.105 0.958 0.889 0.875 0.625 CB 1.382 8 residues pruned to eliminate duplicates Z: 19 43.752 2.169 1.084 0.902 1.000 0.667 CA 1.627 19 residues pruned to eliminate duplicates Z: 12 12.383 2.162 0.897 0.694 0.636 0.273 CB 1.198 12 residues pruned to eliminate duplicates Z: 15 18.015 2.128 0.850 0.497 0.786 0.571 CA 1.561 10 residues pruned to eliminate duplicates Z: 9 9.821 1.737 0.860 0.479 0.750 0.625 C 1.463 9 residues pruned to eliminate duplicates Z: 9 10.605 1.889 0.457 0.733 0.875 0.875 CB 1.263 9 residues pruned to eliminate duplicates Z: 25 14.979 1.989 0.728 0.306 0.875 0.458 CB 1.262 12 residues pruned to eliminate duplicates Z: 6 20.262 2.126 1.198 0.813 1.000 0.800 CB 1.477 6 residues pruned to eliminate duplicates Z: 27 55.926 2.295 1.513 0.851 1.000 0.615 CB 1.408 27 residues pruned to eliminate duplicates Z: 18 28.358 1.996 0.726 0.932 0.941 0.882 CB 1.481 18 residues pruned to eliminate duplicates Z: 58 40.233 2.130 1.034 0.533 0.877 0.579 CB 1.358 53 residues pruned to eliminate duplicates Z: 9 26.061 2.129 1.294 0.906 0.875 0.875 CB 1.534 9 residues pruned to eliminate duplicates Z: 20 11.587 1.698 0.615 0.512 0.842 0.579 CB 1.138 20 residues pruned to eliminate duplicates Z: 6 9.149 1.748 0.638 0.665 0.800 0.600 C 1.534 Z: 25 42.111 2.222 1.019 0.888 0.958 0.875 CA 1.440 25 residues pruned to eliminate duplicates Z: 36 39.434 2.151 0.833 0.707 0.914 0.657 CB 1.532 36 residues pruned to eliminate duplicates Z: 7 10.330 1.644 0.747 0.793 0.833 0.833 O 1.363 7 residues pruned to eliminate duplicates Z: 46 20.196 2.012 0.743 0.387 0.822 0.467 CB 1.177 54 residues pruned to eliminate duplicates Z: 12 21.392 2.011 0.591 0.872 1.000 0.909 CA 1.470 12 residues pruned to eliminate duplicates Z: 20 36.713 2.069 0.951 0.865 1.000 0.842 CA 1.528 20 residues pruned to eliminate duplicates Z: 11 20.686 1.963 0.754 0.812 1.000 0.500 CA 1.447 11 residues pruned to eliminate duplicates Z: 9 13.367 1.948 0.501 0.794 0.875 0.750 CB 1.428 9 residues pruned to eliminate duplicates Z: 23 42.854 2.299 1.221 0.907 0.864 0.364 CB 1.472 23 residues pruned to eliminate duplicates Z: 18 32.718 2.268 1.118 0.572 1.000 0.824 CA 1.541 18 residues pruned to eliminate duplicates Z: 18 28.789 1.934 0.890 0.897 0.941 0.353 CB 1.453 18 residues pruned to eliminate duplicates Z: 10 14.730 1.769 0.895 0.899 1.000 0.889 CB 1.047 Z: 19 26.084 1.874 0.821 0.856 1.000 0.778 CB 1.328 19 residues pruned to eliminate duplicates Z: 11 21.237 1.956 0.873 0.873 0.900 0.900 CB 1.483 11 residues pruned to eliminate duplicates Z: 18 30.455 1.986 1.061 0.883 0.941 0.882 CA 1.387 17 residues pruned to eliminate duplicates Z: 9 24.607 2.243 1.050 0.902 1.000 0.875 CA 1.349 9 residues pruned to eliminate duplicates Z: 6 3.767 1.727 0.436 0.296 0.600 0.400 CB 1.422 Z: 6 9.713 1.841 0.341 0.864 1.000 1.000 CA 1.290 6 residues pruned to eliminate duplicates Z: 15 8.123 1.744 0.277 0.342 1.000 0.643 CB 1.158 15 residues pruned to eliminate duplicates Z: 14 9.748 1.785 0.945 0.421 0.846 0.538 CB 0.999 14 residues pruned to eliminate duplicates Z: 6 2.996 1.724 0.567 0.300 0.800 0.600 CB 0.775 Z: 8 17.109 2.229 1.359 0.800 0.857 0.714 CB 1.103 8 residues pruned to eliminate duplicates Z: 20 20.934 2.055 1.124 0.757 0.895 0.789 CA 0.978 20 residues pruned to eliminate duplicates Z: 7 11.423 1.822 0.747 0.809 1.000 0.833 CA 1.119 4 residues pruned to eliminate duplicates Z: 11 8.687 2.001 0.758 0.267 0.700 0.500 CB 1.455 11 residues pruned to eliminate duplicates Z: 11 18.999 1.833 0.919 0.802 0.900 0.600 CA 1.458 11 residues pruned to eliminate duplicates Z: 20 40.627 2.229 1.187 0.886 1.000 0.789 CA 1.380 20 residues pruned to eliminate duplicates Z: 22 30.476 1.833 1.059 0.924 1.000 0.762 CB 1.237 22 residues pruned to eliminate duplicates Z: 18 29.770 2.148 0.927 0.891 0.941 0.765 CA 1.333 18 residues pruned to eliminate duplicates Z: 20 31.207 2.012 0.827 0.852 0.947 0.789 CB 1.520 20 residues pruned to eliminate duplicates Z: 11 20.352 1.811 0.974 0.884 1.000 0.600 CA 1.301 11 residues pruned to eliminate duplicates Z: 7 12.382 1.833 0.793 0.813 0.833 0.833 N 1.406 Z: 21 25.594 2.066 1.036 0.545 0.950 0.800 CB 1.371 21 residues pruned to eliminate duplicates Z: 14 12.390 1.952 0.626 0.563 0.923 0.615 CB 1.103 14 residues pruned to eliminate duplicates Z: 10 14.010 1.924 0.719 0.636 0.889 0.778 N 1.398 Z: 6 4.014 1.697 0.703 0.798 0.400 0.400 N 1.195 Z: 10 16.276 1.826 0.947 0.817 0.889 0.778 C 1.304 10 residues pruned to eliminate duplicates Z: 9 20.356 2.022 1.405 0.834 0.875 0.625 CA 1.267 9 residues pruned to eliminate duplicates Z: 6 2.940 1.474 0.326 0.629 0.800 0.800 N 0.745 Z: 12 5.230 1.645 0.438 0.387 0.636 0.455 N 1.180 Z: 23 46.966 2.358 1.015 0.884 0.955 0.773 CA 1.596 23 residues pruned to eliminate duplicates Z: 20 30.693 1.964 1.196 0.919 0.895 0.737 CB 1.286 20 residues pruned to eliminate duplicates Z: 9 17.162 1.977 0.692 0.871 1.000 1.000 CB 1.323 9 residues pruned to eliminate duplicates Z: 38 33.953 2.063 0.922 0.627 0.865 0.622 CB 1.444 40 residues pruned to eliminate duplicates Z: 27 25.816 2.040 0.720 0.502 0.923 0.769 CA 1.561 29 residues pruned to eliminate duplicates Z: 12 13.381 2.074 0.741 0.436 0.909 0.636 CB 1.313 12 residues pruned to eliminate duplicates Z: 19 11.404 1.946 0.585 0.369 0.833 0.333 CB 1.204 19 residues pruned to eliminate duplicates Z: 33 23.502 2.036 0.669 0.570 0.875 0.562 CA 1.306 33 residues pruned to eliminate duplicates Z: 12 16.322 1.876 0.832 0.729 0.909 0.727 CA 1.281 12 residues pruned to eliminate duplicates Z: 11 22.726 1.867 0.838 0.859 1.000 0.800 N 1.541 11 residues pruned to eliminate duplicates Z: 11 21.687 1.983 0.662 0.896 1.000 0.900 CA 1.490 11 residues pruned to eliminate duplicates Z: 10 13.966 1.928 0.483 0.862 1.000 1.000 CB 1.195 10 residues pruned to eliminate duplicates Z: 15 19.448 2.042 0.805 0.561 1.000 0.714 CA 1.329 16 residues pruned to eliminate duplicates Z: 16 25.091 1.945 0.756 0.943 1.000 1.000 CA 1.315 16 residues pruned to eliminate duplicates Z: 17 9.623 1.897 0.716 0.284 0.625 0.438 CB 1.509 19 residues pruned to eliminate duplicates Z: 16 10.565 1.901 0.606 0.322 0.867 0.467 CB 1.254 11 residues pruned to eliminate duplicates Z: 18 31.101 2.018 0.722 0.901 1.000 0.824 CA 1.549 18 residues pruned to eliminate duplicates Z: 9 10.242 1.726 0.444 0.682 0.875 0.375 CA 1.405 9 residues pruned to eliminate duplicates Z: 33 34.349 2.200 1.419 0.436 0.781 0.500 CB 1.560 33 residues pruned to eliminate duplicates Z: 18 37.231 2.398 0.798 0.876 0.882 0.765 CA 1.726 18 residues pruned to eliminate duplicates Z: 20 21.775 2.081 1.024 0.535 0.842 0.579 CA 1.361 17 residues pruned to eliminate duplicates Z: 25 44.263 2.329 1.016 0.873 0.917 0.708 CA 1.529 25 residues pruned to eliminate duplicates Z: 18 32.459 2.291 0.930 0.923 0.941 0.706 CA 1.329 18 residues pruned to eliminate duplicates Z: 9 17.904 1.995 0.787 0.793 0.875 0.625 CA 1.569 9 residues pruned to eliminate duplicates Z: 19 21.842 1.846 0.770 0.817 0.944 0.611 CB 1.266 18 residues pruned to eliminate duplicates Z: 8 8.739 1.904 0.564 0.520 0.857 0.714 N 1.269 6 residues pruned to eliminate duplicates Z: 8 9.465 1.856 0.655 0.375 1.000 0.571 CB 1.330 7 residues pruned to eliminate duplicates Z: 7 6.536 1.805 0.055 0.748 1.000 0.500 CB 1.122 Z: 11 20.001 1.912 0.780 0.863 1.000 1.000 CA 1.364 11 residues pruned to eliminate duplicates Z: 9 19.891 1.747 1.307 0.879 1.000 0.875 CA 1.265 9 residues pruned to eliminate duplicates Z: 9 12.544 1.733 0.654 0.862 1.000 0.500 CB 1.136 9 residues pruned to eliminate duplicates Z: 20 29.571 2.077 0.729 0.877 0.947 0.895 CB 1.448 20 residues pruned to eliminate duplicates Z: 7 6.901 1.569 0.654 0.534 0.833 0.667 CA 1.260 7 residues pruned to eliminate duplicates Z: 7 4.951 1.887 0.493 0.404 0.667 0.500 CB 1.191 Z: 6 4.128 1.436 0.729 0.633 0.800 0.800 CA 0.820 6 residues pruned to eliminate duplicates Z: 30 27.820 2.138 1.085 0.433 0.828 0.483 CB 1.501 30 residues pruned to eliminate duplicates Z: 18 39.550 2.170 1.239 0.906 0.941 0.765 CB 1.492 18 residues pruned to eliminate duplicates Z: 12 21.334 1.891 0.978 0.898 0.818 0.364 CB 1.504 12 residues pruned to eliminate duplicates Z: 7 18.571 2.178 0.895 0.722 1.000 0.833 CB 1.503 Z: 14 35.051 1.989 1.418 0.869 1.000 0.846 CA 1.477 14 residues pruned to eliminate duplicates Z: 9 3.257 1.566 0.733 0.579 0.750 0.250 CB 0.524 Z: 14 13.614 1.992 0.653 0.474 0.846 0.538 CB 1.392 14 residues pruned to eliminate duplicates Z: 42 46.549 2.262 1.447 0.593 0.854 0.512 CB 1.407 35 residues pruned to eliminate duplicates Z: 11 14.317 1.912 0.856 0.798 0.900 0.500 CB 1.092 11 residues pruned to eliminate duplicates Z: 10 5.664 1.595 0.928 0.290 0.778 0.444 CB 0.999 Z: 6 5.898 1.552 0.235 0.823 1.000 0.600 CA 1.040 Z: 11 10.622 1.976 0.870 0.418 0.800 0.400 CA 1.238 11 residues pruned to eliminate duplicates Z: 39 16.791 1.903 0.534 0.423 0.789 0.447 CB 1.281 39 residues pruned to eliminate duplicates Z: 7 2.547 1.462 0.716 0.370 0.667 0.333 CB 0.715 7 residues pruned to eliminate duplicates Z: 53 50.898 2.228 1.049 0.595 0.885 0.654 CA 1.597 54 residues pruned to eliminate duplicates Z: 16 15.701 1.807 0.528 0.924 1.000 0.867 CB 1.031 16 residues pruned to eliminate duplicates Z: 12 13.156 1.835 0.321 0.811 0.909 0.545 CB 1.373 12 residues pruned to eliminate duplicates Z: 29 19.068 1.969 0.656 0.435 0.857 0.571 CB 1.379 26 residues pruned to eliminate duplicates Z: 20 28.846 2.005 0.825 0.805 0.895 0.632 CB 1.549 20 residues pruned to eliminate duplicates Z: 20 43.708 2.133 1.183 0.925 1.000 0.684 CA 1.511 20 residues pruned to eliminate duplicates Z: 10 18.535 1.994 0.780 0.686 1.000 0.889 CA 1.468 10 residues pruned to eliminate duplicates Z: 7 9.521 1.975 0.736 0.721 0.667 0.667 CB 1.393 Z: 8 12.346 1.933 0.508 0.844 0.857 0.857 CB 1.390 8 residues pruned to eliminate duplicates Z: 6 10.077 1.758 0.598 0.872 1.000 1.000 N 1.169 6 residues pruned to eliminate duplicates Z: 23 52.013 2.373 1.618 0.877 0.909 0.273 CB 1.426 23 residues pruned to eliminate duplicates Z: 12 17.088 1.875 0.685 0.877 0.909 0.727 CB 1.302 12 residues pruned to eliminate duplicates Z: 8 17.352 2.220 0.920 0.833 0.714 0.714 CB 1.616 8 residues pruned to eliminate duplicates Z: 21 29.019 2.062 0.727 0.863 0.950 0.800 CA 1.407 21 residues pruned to eliminate duplicates Z: 6 3.345 1.300 0.665 0.648 0.800 0.800 CB 0.752 Z: 11 21.449 1.918 0.689 0.870 1.000 0.800 CA 1.528 11 residues pruned to eliminate duplicates Z: 11 11.020 1.785 0.810 0.572 0.900 0.700 CB 1.118 11 residues pruned to eliminate duplicates Z: 19 23.719 1.966 0.671 0.889 0.944 0.778 CA 1.297 19 residues pruned to eliminate duplicates Z: 6 3.087 1.782 0.283 0.291 0.600 0.400 N 1.272 6 residues pruned to eliminate duplicates 6 1.730 1.306 0.603 0.114 0.800 0.400 C 0.752 ? Z: 25 56.818 2.363 1.486 0.854 0.917 0.625 CA 1.591 25 residues pruned to eliminate duplicates Z: 12 31.521 2.159 1.215 0.817 0.909 0.818 CA 1.660 12 residues pruned to eliminate duplicates Z: 12 13.897 1.849 0.890 0.780 0.909 0.818 CA 1.030 12 residues pruned to eliminate duplicates Z: 20 32.491 1.971 1.116 0.892 0.842 0.632 CB 1.525 20 residues pruned to eliminate duplicates Z: 18 27.081 1.920 0.646 0.888 1.000 0.824 CA 1.497 18 residues pruned to eliminate duplicates Z: 20 21.098 1.762 0.625 0.865 0.947 0.842 CA 1.307 20 residues pruned to eliminate duplicates Z: 11 12.229 1.870 0.365 0.809 0.800 0.700 CB 1.446 11 residues pruned to eliminate duplicates Z: 11 19.905 1.879 0.708 0.908 1.000 1.000 CA 1.393 11 residues pruned to eliminate duplicates Z: 21 11.635 1.795 0.552 0.267 0.900 0.550 CB 1.353 21 residues pruned to eliminate duplicates Z: 8 4.317 1.396 0.607 0.630 0.857 0.714 CB 0.751 Z: 9 19.033 2.093 1.353 0.773 0.750 0.625 CA 1.432 9 residues pruned to eliminate duplicates Z: 8 5.103 1.803 0.235 0.401 0.714 0.429 N 1.346 Z: 19 26.313 2.074 0.694 0.916 1.000 0.889 CA 1.246 19 residues pruned to eliminate duplicates Z: 27 26.388 2.273 0.630 0.446 0.923 0.615 CB 1.600 27 residues pruned to eliminate duplicates Z: 21 27.424 1.860 0.987 0.866 0.900 0.650 CB 1.350 21 residues pruned to eliminate duplicates Z: 9 18.273 1.956 0.987 0.812 1.000 0.875 CA 1.267 9 residues pruned to eliminate duplicates Z: 18 29.370 1.981 0.789 0.862 1.000 0.824 CB 1.476 18 residues pruned to eliminate duplicates Z: 10 7.100 1.673 0.211 0.686 1.000 0.222 CB 0.984 10 residues pruned to eliminate duplicates Z: 20 30.421 1.989 0.774 0.861 0.947 0.789 CA 1.534 20 residues pruned to eliminate duplicates Z: 18 18.736 2.078 0.877 0.895 0.941 0.765 CA 0.887 18 residues pruned to eliminate duplicates Z: 6 5.634 1.673 0.290 0.689 1.000 0.800 CB 0.982 6 residues pruned to eliminate duplicates Z: 24 47.318 2.361 1.001 0.904 0.957 0.739 CA 1.556 24 residues pruned to eliminate duplicates Z: 19 40.280 2.139 0.943 0.890 1.000 0.667 CA 1.642 19 residues pruned to eliminate duplicates Z: 19 40.615 2.132 1.470 0.872 0.944 0.500 CA 1.403 19 residues pruned to eliminate duplicates Z: 16 27.517 2.266 1.097 0.921 0.933 0.800 CA 1.127 16 residues pruned to eliminate duplicates Z: 11 6.018 1.543 0.920 0.309 0.700 0.600 CB 1.135 11 residues pruned to eliminate duplicates Z: 10 6.763 1.954 0.438 0.407 0.667 0.556 CB 1.327 10 residues pruned to eliminate duplicates Z: 22 31.724 1.983 0.809 0.870 1.000 0.524 CA 1.409 20 residues pruned to eliminate duplicates Z: 10 20.030 1.953 1.078 0.864 0.889 0.444 CA 1.357 10 residues pruned to eliminate duplicates Z: 11 21.680 1.971 0.606 0.924 1.000 1.000 CB 1.521 11 residues pruned to eliminate duplicates Z: 37 38.743 2.116 0.899 0.650 0.944 0.667 CB 1.480 37 residues pruned to eliminate duplicates Z: 9 3.820 1.632 0.250 0.413 0.750 0.500 CA 0.966 Z: 24 59.297 2.281 1.402 0.914 0.957 0.478 CB 1.669 24 residues pruned to eliminate duplicates Z: 47 34.001 2.162 0.906 0.454 0.913 0.587 CB 1.397 47 residues pruned to eliminate duplicates Z: 7 7.186 1.831 0.775 0.513 0.667 0.500 CB 1.337 7 residues pruned to eliminate duplicates Z: 25 45.683 2.268 1.144 0.894 0.958 0.792 CA 1.435 25 residues pruned to eliminate duplicates 6 1.685 1.529 0.755 0.367 0.600 0.600 CB 0.540 ? Z: 7 9.699 1.974 0.329 0.551 1.000 0.833 CB 1.436 9 residues pruned to eliminate duplicates Z: 9 9.694 1.727 0.370 0.708 1.000 0.625 CA 1.199 9 residues pruned to eliminate duplicates Z: 34 23.989 2.114 0.859 0.401 0.818 0.485 CB 1.442 34 residues pruned to eliminate duplicates Z: 20 47.464 2.137 1.159 0.916 1.000 0.474 CA 1.666 20 residues pruned to eliminate duplicates Z: 14 13.387 1.878 0.655 0.454 0.923 0.462 CB 1.356 14 residues pruned to eliminate duplicates Z: 20 30.435 2.013 0.696 0.882 1.000 0.789 CA 1.480 20 residues pruned to eliminate duplicates Z: 12 12.805 2.050 0.898 0.336 0.818 0.455 CB 1.450 7 residues pruned to eliminate duplicates Z: 17 34.327 2.172 1.109 0.876 0.938 0.688 CA 1.452 17 residues pruned to eliminate duplicates Z: 11 14.640 1.929 0.684 0.836 0.900 0.400 CB 1.185 11 residues pruned to eliminate duplicates Z: 7 10.469 1.970 0.375 0.753 1.000 0.833 CA 1.259 7 residues pruned to eliminate duplicates Z: 17 35.786 2.358 1.338 0.694 0.812 0.625 CA 1.672 15 residues pruned to eliminate duplicates Z: 55 43.906 2.163 0.970 0.574 0.889 0.685 CB 1.469 59 residues pruned to eliminate duplicates Z: 12 21.660 1.831 0.771 0.862 1.000 0.727 CB 1.478 12 residues pruned to eliminate duplicates Z: 25 49.921 2.356 1.182 0.900 1.000 0.667 CA 1.416 25 residues pruned to eliminate duplicates Z: 7 8.755 1.797 0.970 0.698 0.833 0.667 CA 1.011 7 residues pruned to eliminate duplicates Z: 9 10.281 2.063 0.628 0.881 0.750 0.625 CA 1.046 9 residues pruned to eliminate duplicates Z: 17 29.146 1.949 0.955 0.916 1.000 0.812 CA 1.351 17 residues pruned to eliminate duplicates Z: 6 5.606 1.698 0.609 0.445 0.800 0.600 N 1.214 Z: 21 37.211 2.029 1.041 0.857 1.000 0.750 CA 1.481 21 residues pruned to eliminate duplicates Z: 25 55.933 2.376 1.326 0.915 0.917 0.708 CB 1.592 25 residues pruned to eliminate duplicates Z: 11 16.812 1.871 0.865 0.812 0.900 0.800 CA 1.291 11 residues pruned to eliminate duplicates Z: 13 15.779 2.106 1.254 0.514 0.667 0.333 CB 1.419 13 residues pruned to eliminate duplicates Z: 13 10.358 1.874 0.557 0.326 1.000 0.667 CB 1.241 8 residues pruned to eliminate duplicates Z: 20 39.330 2.148 0.924 0.884 0.947 0.526 CA 1.665 20 residues pruned to eliminate duplicates Z: 39 33.363 2.068 0.828 0.639 0.895 0.737 CB 1.404 39 residues pruned to eliminate duplicates Z: 51 41.038 2.146 1.034 0.542 0.880 0.600 CB 1.449 51 residues pruned to eliminate duplicates Z: 8 4.505 1.765 0.003 0.351 0.857 0.714 CB 1.318 Z: 21 29.873 2.075 1.067 0.838 0.900 0.600 CA 1.293 21 residues pruned to eliminate duplicates Z: 15 20.278 1.961 1.065 0.477 0.857 0.500 CA 1.598 15 residues pruned to eliminate duplicates Z: 12 12.132 1.968 0.677 0.475 0.909 0.818 CB 1.251 12 residues pruned to eliminate duplicates Z: 10 6.340 1.739 0.438 0.271 0.889 0.333 N 1.234 Z: 10 5.786 1.692 0.505 0.306 0.778 0.444 CB 1.209 10 residues pruned to eliminate duplicates Z: 25 36.388 2.261 0.747 0.892 0.958 0.958 CA 1.409 25 residues pruned to eliminate duplicates Z: 8 7.304 1.308 0.800 0.739 1.000 0.714 CA 0.946 Z: 7 3.484 1.919 0.386 0.237 0.500 0.333 CB 1.451 6 residues pruned to eliminate duplicates Z: 7 17.175 1.938 0.744 0.849 1.000 0.833 N 1.538 7 residues pruned to eliminate duplicates Z: 16 11.423 1.871 1.205 0.371 0.800 0.467 CB 1.025 10 residues pruned to eliminate duplicates Z: 14 25.825 1.953 1.099 0.853 0.923 0.769 CA 1.399 14 residues pruned to eliminate duplicates Z: 27 50.588 2.375 1.324 0.704 1.000 0.731 CA 1.493 27 residues pruned to eliminate duplicates Z: 45 32.381 2.232 0.865 0.438 0.909 0.591 CB 1.375 45 residues pruned to eliminate duplicates Z: 27 16.428 1.909 0.689 0.498 0.808 0.462 CB 1.239 31 residues pruned to eliminate duplicates Z: 8 7.555 1.747 0.854 0.874 0.714 0.429 CB 0.898 8 residues pruned to eliminate duplicates Z: 10 12.842 1.959 0.626 0.843 0.889 0.667 CA 1.126 10 residues pruned to eliminate duplicates Z: 32 31.788 2.049 0.781 0.641 0.903 0.742 CA 1.518 32 residues pruned to eliminate duplicates Z: 6 3.316 1.621 0.390 0.308 0.800 0.400 CB 1.018 Z: 21 29.261 1.889 1.006 0.862 0.950 0.700 CA 1.335 21 residues pruned to eliminate duplicates Z: 11 16.326 1.911 0.768 0.901 0.900 0.600 CA 1.211 11 residues pruned to eliminate duplicates Z: 42 28.554 2.160 0.676 0.505 0.927 0.585 CB 1.322 42 residues pruned to eliminate duplicates Z: 18 38.834 2.252 1.445 0.921 0.882 0.588 CB 1.364 18 residues pruned to eliminate duplicates Z: 18 28.549 2.145 1.184 0.897 0.941 0.706 CA 1.124 18 residues pruned to eliminate duplicates Z: 7 7.177 1.792 0.573 0.742 0.833 0.833 CA 1.004 7 residues pruned to eliminate duplicates Z: 21 34.344 2.031 0.897 0.881 1.000 0.700 CA 1.443 21 residues pruned to eliminate duplicates Z: 19 27.558 1.898 1.023 0.872 0.944 0.500 CB 1.305 19 residues pruned to eliminate duplicates Z: 9 10.863 1.788 0.705 0.789 0.875 0.875 CB 1.117 Z: 8 20.012 2.042 1.205 0.800 0.857 0.571 CA 1.508 9 residues pruned to eliminate duplicates Z: 19 27.943 2.239 0.838 0.928 0.944 0.889 CA 1.187 19 residues pruned to eliminate duplicates Z: 49 32.936 2.009 0.730 0.540 0.875 0.562 CB 1.503 49 residues pruned to eliminate duplicates Z: 13 18.315 2.075 0.542 0.677 0.917 0.750 CA 1.531 13 residues pruned to eliminate duplicates Z: 11 21.816 1.941 0.560 0.907 1.000 1.000 CA 1.620 11 residues pruned to eliminate duplicates Z: 15 11.496 2.041 0.704 0.253 0.857 0.357 CA 1.368 15 residues pruned to eliminate duplicates Z: 7 3.352 1.608 0.469 0.466 1.000 1.000 CB 0.599 Z: 7 5.034 1.775 0.097 0.415 1.000 0.667 CA 1.155 9 residues pruned to eliminate duplicates Z: 24 17.524 1.924 0.720 0.516 0.870 0.696 CA 1.249 19 residues pruned to eliminate duplicates Z: 40 21.387 1.848 0.607 0.555 0.872 0.538 CB 1.254 25 residues pruned to eliminate duplicates Z: 19 20.582 1.843 0.491 0.829 0.944 0.722 CB 1.407 19 residues pruned to eliminate duplicates Z: 19 17.272 1.815 0.692 0.896 0.889 0.833 CA 1.068 19 residues pruned to eliminate duplicates Z: 11 20.691 2.053 0.865 0.859 0.900 0.800 CA 1.396 11 residues pruned to eliminate duplicates Z: 13 25.231 2.005 0.983 0.829 0.917 0.500 CA 1.504 13 residues pruned to eliminate duplicates Z: 6 3.783 1.279 1.313 0.597 0.600 0.400 C 0.869 Z: 7 13.734 2.116 0.566 0.876 0.833 0.500 CB 1.476 7 residues pruned to eliminate duplicates Z: 25 47.742 2.345 1.134 0.870 0.917 0.792 CA 1.551 25 residues pruned to eliminate duplicates Z: 19 27.105 1.896 1.026 0.837 1.000 0.667 CB 1.244 19 residues pruned to eliminate duplicates Z: 31 16.620 1.992 0.420 0.466 0.900 0.533 CB 1.234 31 residues pruned to eliminate duplicates Z: 10 4.091 1.706 0.566 0.368 0.556 0.444 CB 1.058 Z: 10 17.878 2.247 1.064 0.569 1.000 0.778 CA 1.202 15 residues pruned to eliminate duplicates Z: 13 23.550 2.033 1.202 0.884 0.833 0.667 CA 1.316 13 residues pruned to eliminate duplicates Z: 8 7.549 1.846 0.237 0.612 0.857 0.714 CA 1.311 8 residues pruned to eliminate duplicates Z: 9 21.751 2.191 0.970 0.917 1.000 0.875 CB 1.257 13 residues pruned to eliminate duplicates Z: 17 12.696 2.206 0.809 0.388 0.812 0.562 CB 1.102 17 residues pruned to eliminate duplicates Z: 24 60.508 2.411 1.382 0.918 0.957 0.696 CB 1.619 24 residues pruned to eliminate duplicates Z: 21 29.732 1.960 0.841 0.892 1.000 0.850 CA 1.324 21 residues pruned to eliminate duplicates Z: 19 30.492 2.081 0.750 0.862 0.944 0.556 CB 1.534 19 residues pruned to eliminate duplicates Z: 8 9.420 1.775 0.709 0.788 0.857 0.857 CB 1.063 8 residues pruned to eliminate duplicates Z: 25 60.203 2.374 1.321 0.915 0.958 0.708 CB 1.645 26 residues pruned to eliminate duplicates Z: 9 3.724 1.863 0.322 0.519 0.750 0.625 CB 0.699 9 residues pruned to eliminate duplicates Z: 9 16.596 2.179 1.018 0.606 0.875 0.750 CB 1.378 9 residues pruned to eliminate duplicates Z: 21 26.718 1.913 0.753 0.854 0.950 0.800 CB 1.385 21 residues pruned to eliminate duplicates Z: 6 9.017 1.963 0.306 0.724 1.000 0.800 CB 1.285 6 residues pruned to eliminate duplicates Z: 21 16.627 2.057 0.724 0.455 0.750 0.550 CA 1.463 21 residues pruned to eliminate duplicates Z: 25 22.504 1.810 0.814 0.588 0.917 0.583 CB 1.402 25 residues pruned to eliminate duplicates Z: 6 4.757 1.421 0.607 0.512 1.000 0.600 CA 0.920 7 1.334 1.446 0.479 0.408 0.667 0.333 CB 0.420 ? Z: 34 45.306 2.185 1.038 0.707 0.970 0.727 CB 1.513 34 residues pruned to eliminate duplicates Z: 21 36.605 2.004 1.037 0.886 1.000 0.750 CA 1.447 21 residues pruned to eliminate duplicates Z: 21 16.959 2.032 0.955 0.349 0.800 0.450 CB 1.406 20 residues pruned to eliminate duplicates Z: 12 9.021 1.822 0.886 0.283 0.727 0.545 N 1.390 Z: 17 8.299 1.906 0.490 0.175 0.750 0.375 CB 1.443 16 residues pruned to eliminate duplicates Z: 8 7.548 1.685 0.317 0.833 0.857 0.714 CA 1.126 8 residues pruned to eliminate duplicates Z: 23 13.977 1.968 0.835 0.322 0.864 0.455 CB 1.161 11 residues pruned to eliminate duplicates Z: 6 2.471 1.643 -0.026 0.167 1.000 0.600 C 1.036 Z: 23 41.260 2.368 0.829 0.929 1.000 0.955 CA 1.422 23 residues pruned to eliminate duplicates Z: 7 5.907 1.973 0.982 0.516 1.000 0.667 CB 0.607 7 residues pruned to eliminate duplicates Z: 25 35.391 2.171 0.774 0.950 1.000 0.958 CA 1.293 25 residues pruned to eliminate duplicates Z: 19 33.528 2.299 0.785 0.920 1.000 0.778 CA 1.356 19 residues pruned to eliminate duplicates Z: 10 8.351 1.764 0.585 0.406 0.889 0.778 CB 1.237 Z: 25 14.649 1.908 0.868 0.331 0.833 0.583 CB 1.211 26 residues pruned to eliminate duplicates Z: 8 8.733 1.713 0.521 0.873 1.000 1.000 CA 0.923 Z: 17 35.238 2.022 1.111 0.897 1.000 0.812 CB 1.477 17 residues pruned to eliminate duplicates Z: 17 17.938 1.861 0.856 0.524 1.000 0.750 CB 1.268 7 residues pruned to eliminate duplicates Z: 19 37.680 2.222 0.787 0.903 1.000 0.722 CA 1.593 21 residues pruned to eliminate duplicates Z: 7 9.541 1.918 0.253 0.594 1.000 0.500 CB 1.482 7 residues pruned to eliminate duplicates Z: 16 21.482 1.870 0.852 0.890 1.000 0.800 CB 1.152 16 residues pruned to eliminate duplicates Z: 20 24.503 1.891 0.941 0.830 0.842 0.632 CB 1.367 20 residues pruned to eliminate duplicates Z: 6 6.822 1.500 1.487 0.604 0.800 0.600 N 0.927 6 residues pruned to eliminate duplicates Z: 22 28.458 1.831 0.986 0.859 1.000 0.524 CA 1.257 22 residues pruned to eliminate duplicates Z: 12 17.062 1.828 0.676 0.874 0.818 0.636 CB 1.494 12 residues pruned to eliminate duplicates Z: 16 23.918 2.158 0.833 0.850 0.933 0.667 CA 1.239 16 residues pruned to eliminate duplicates Z: 30 27.519 1.934 0.790 0.624 0.931 0.552 CB 1.411 24 residues pruned to eliminate duplicates Z: 28 31.365 2.171 0.637 0.786 0.889 0.593 CB 1.487 28 residues pruned to eliminate duplicates Z: 10 5.935 1.744 0.211 0.410 0.778 0.333 N 1.323 Z: 8 9.064 1.661 0.382 0.746 1.000 0.714 CA 1.198 8 residues pruned to eliminate duplicates Z: 41 25.402 1.953 0.917 0.528 0.825 0.600 CB 1.265 41 residues pruned to eliminate duplicates Z: 11 25.949 2.022 1.448 0.750 0.900 0.400 CB 1.473 11 residues pruned to eliminate duplicates Z: 10 8.539 1.905 0.742 0.567 0.889 0.556 CB 0.905 10 residues pruned to eliminate duplicates Z: 14 24.873 2.092 0.900 0.842 1.000 0.615 CB 1.293 14 residues pruned to eliminate duplicates Z: 12 17.344 1.986 0.622 0.842 0.727 0.545 CB 1.663 12 residues pruned to eliminate duplicates Z: 20 21.763 2.069 0.990 0.492 0.895 0.684 CA 1.366 20 residues pruned to eliminate duplicates Z: 26 12.906 1.959 0.604 0.292 0.840 0.560 CB 1.234 26 residues pruned to eliminate duplicates Z: 11 16.257 1.880 0.496 0.838 0.900 0.600 CA 1.518 11 residues pruned to eliminate duplicates Z: 9 21.685 2.070 0.865 0.835 1.000 0.500 N 1.487 9 residues pruned to eliminate duplicates Z: 11 5.389 1.714 0.624 0.336 0.700 0.400 CB 1.046 5 residues pruned to eliminate duplicates Z: 9 18.022 1.848 0.970 0.876 1.000 0.875 CB 1.272 9 residues pruned to eliminate duplicates Z: 7 7.574 1.856 0.100 0.587 1.000 0.667 N 1.394 Z: 9 12.414 1.969 0.914 0.820 0.750 0.500 CB 1.176 9 residues pruned to eliminate duplicates Z: 7 4.207 1.947 0.192 0.476 0.833 0.500 CB 0.910 7 residues pruned to eliminate duplicates Z: 8 5.565 1.774 0.441 0.421 0.714 0.571 CA 1.251 7 residues pruned to eliminate duplicates Z: 12 27.199 1.996 0.828 0.882 1.000 0.818 CB 1.626 12 residues pruned to eliminate duplicates Z: 7 9.685 1.746 0.514 0.851 1.000 0.833 CA 1.107 7 residues pruned to eliminate duplicates Z: 7 16.675 2.118 1.266 0.388 1.000 0.833 CA 1.597 7 residues pruned to eliminate duplicates Z: 10 12.395 1.777 0.341 0.910 1.000 1.000 CA 1.229 10 residues pruned to eliminate duplicates Z: 7 6.614 1.919 0.451 0.604 0.833 0.833 CA 1.054 7 residues pruned to eliminate duplicates Z: 50 34.426 2.177 0.915 0.445 0.918 0.510 CB 1.359 66 residues pruned to eliminate duplicates Z: 17 24.570 2.242 0.626 0.844 0.875 0.812 CA 1.433 17 residues pruned to eliminate duplicates Z: 10 14.994 1.805 0.854 0.773 0.889 0.889 CB 1.319 9 residues pruned to eliminate duplicates Z: 19 10.184 1.855 0.683 0.248 0.889 0.611 CB 1.157 20 residues pruned to eliminate duplicates Z: 19 40.113 2.074 1.077 0.874 1.000 0.833 CA 1.597 19 residues pruned to eliminate duplicates Z: 21 29.979 1.971 0.804 0.902 1.000 0.850 CA 1.345 21 residues pruned to eliminate duplicates Z: 26 44.528 2.312 1.171 0.840 0.920 0.520 CB 1.439 26 residues pruned to eliminate duplicates Z: 20 27.403 1.988 0.909 0.843 0.842 0.632 CA 1.465 20 residues pruned to eliminate duplicates Z: 8 7.878 1.857 0.438 0.697 0.857 0.714 CB 1.086 8 residues pruned to eliminate duplicates Z: 15 46.140 2.323 1.409 0.895 1.000 0.429 CB 1.579 15 residues pruned to eliminate duplicates Z: 9 20.360 2.011 1.194 0.787 0.875 0.625 CB 1.449 9 residues pruned to eliminate duplicates Z: 10 3.450 1.608 0.418 0.309 0.667 0.333 CB 0.936 Z: 20 31.864 1.889 1.102 0.915 1.000 0.895 CA 1.301 20 residues pruned to eliminate duplicates Z: 25 24.137 1.908 0.738 0.570 0.958 0.583 CB 1.450 18 residues pruned to eliminate duplicates Z: 21 27.765 1.928 0.829 0.867 0.950 0.750 CB 1.355 21 residues pruned to eliminate duplicates Z: 9 14.041 1.861 0.696 0.786 0.875 0.750 CB 1.397 9 residues pruned to eliminate duplicates Z: 21 23.118 1.770 0.641 0.867 0.900 0.850 CA 1.447 21 residues pruned to eliminate duplicates Z: 20 20.893 1.773 1.011 0.737 0.895 0.526 CA 1.215 20 residues pruned to eliminate duplicates Z: 20 31.695 2.060 0.849 0.846 0.947 0.737 CA 1.498 20 residues pruned to eliminate duplicates Z: 6 2.023 1.320 0.216 0.623 0.800 0.600 CB 0.628 Z: 11 4.470 1.621 0.559 0.403 0.800 0.300 CB 0.774 Z: 16 19.146 1.934 1.186 0.476 0.800 0.533 CB 1.497 16 residues pruned to eliminate duplicates Z: 12 7.925 1.932 0.865 0.380 0.636 0.545 CB 1.185 12 residues pruned to eliminate duplicates Z: 8 12.658 1.859 0.643 0.872 0.857 0.857 CA 1.332 7 residues pruned to eliminate duplicates Z: 21 29.415 1.965 0.983 0.811 0.900 0.650 CA 1.430 21 residues pruned to eliminate duplicates Z: 18 32.490 1.971 1.092 0.892 0.941 0.647 CA 1.459 18 residues pruned to eliminate duplicates Z: 10 8.973 1.820 0.473 0.362 1.000 0.333 CA 1.293 10 residues pruned to eliminate duplicates Z: 19 27.829 1.960 0.798 0.878 1.000 0.778 CA 1.351 19 residues pruned to eliminate duplicates Z: 17 9.337 1.830 0.396 0.430 0.875 0.500 CB 1.122 17 residues pruned to eliminate duplicates Z: 6 3.502 1.588 0.182 0.765 0.800 0.600 O 0.824 Z: 34 46.387 2.262 1.102 0.731 0.970 0.667 CB 1.423 39 residues pruned to eliminate duplicates Z: 7 6.621 1.961 0.343 0.247 1.000 0.667 CB 1.373 Z: 12 12.287 1.934 0.911 0.336 0.818 0.455 CB 1.466 12 residues pruned to eliminate duplicates Z: 14 15.668 1.886 1.031 0.304 0.923 0.538 CB 1.528 14 residues pruned to eliminate duplicates Z: 38 44.787 2.290 0.989 0.689 0.919 0.703 CA 1.479 38 residues pruned to eliminate duplicates Z: 9 7.175 1.947 0.249 0.417 1.000 0.750 CB 1.138 9 residues pruned to eliminate duplicates Z: 39 30.810 2.039 1.021 0.596 0.842 0.526 CB 1.315 39 residues pruned to eliminate duplicates 7 1.487 1.740 0.185 0.614 0.833 0.500 CB 0.317 ? Z: 40 32.578 2.065 0.777 0.586 0.923 0.667 CB 1.418 40 residues pruned to eliminate duplicates Z: 20 29.800 2.007 0.717 0.873 1.000 0.737 CA 1.445 20 residues pruned to eliminate duplicates 6 1.950 1.445 0.665 0.341 0.600 0.400 CB 0.718 ? Z: 16 11.980 1.874 0.762 0.306 0.867 0.600 CB 1.341 7 residues pruned to eliminate duplicates Z: 21 31.793 2.191 1.350 0.546 0.850 0.600 CB 1.554 21 residues pruned to eliminate duplicates Z: 20 32.904 2.060 0.672 0.910 1.000 0.842 CA 1.554 20 residues pruned to eliminate duplicates Z: 14 16.964 2.043 1.442 0.444 0.692 0.385 CB 1.443 14 residues pruned to eliminate duplicates Z: 8 3.140 1.618 0.503 0.211 0.714 0.286 CB 0.960 Z: 13 17.155 1.823 0.703 0.872 1.000 0.750 CA 1.163 13 residues pruned to eliminate duplicates Z: 19 23.392 1.884 0.433 0.890 0.944 0.667 CB 1.555 19 residues pruned to eliminate duplicates Z: 19 21.705 1.961 0.903 0.697 0.833 0.333 CB 1.375 19 residues pruned to eliminate duplicates Z: 25 37.292 2.343 0.942 0.858 0.958 0.750 CA 1.286 25 residues pruned to eliminate duplicates Z: 20 35.408 2.118 0.894 0.909 1.000 0.895 CA 1.437 20 residues pruned to eliminate duplicates Z: 9 9.566 1.703 0.319 0.774 1.000 0.875 CA 1.182 Z: 20 21.500 1.877 0.559 0.921 1.000 0.895 CB 1.187 20 residues pruned to eliminate duplicates Z: 24 35.051 2.257 1.205 0.700 0.826 0.391 CA 1.482 24 residues pruned to eliminate duplicates Z: 7 2.404 1.472 0.561 0.246 0.667 0.333 CA 0.859 Z: 11 14.968 1.832 1.111 0.823 0.900 0.500 CB 1.028 11 residues pruned to eliminate duplicates Z: 40 32.917 2.058 1.004 0.565 0.923 0.692 CB 1.300 44 residues pruned to eliminate duplicates Z: 13 3.704 1.725 0.802 0.254 0.583 0.417 CB 0.782 13 residues pruned to eliminate duplicates Z: 20 27.624 1.883 0.947 0.872 1.000 0.789 CA 1.260 20 residues pruned to eliminate duplicates Z: 7 7.048 1.842 0.273 0.589 1.000 0.500 CA 1.127 Z: 7 5.548 1.824 0.772 0.403 0.667 0.667 CA 1.165 Z: 9 16.631 2.017 0.859 0.843 0.875 0.625 CA 1.335 9 residues pruned to eliminate duplicates Z: 9 8.947 1.711 0.364 0.848 0.875 0.750 CA 1.149 9 residues pruned to eliminate duplicates 8 1.801 1.550 0.983 0.204 0.571 0.571 CB 0.551 ? Z: 20 20.797 1.911 0.738 0.843 0.789 0.579 CA 1.355 20 residues pruned to eliminate duplicates Z: 9 11.688 1.875 0.420 0.769 1.000 0.500 CB 1.223 9 residues pruned to eliminate duplicates Z: 8 4.049 1.427 0.849 0.232 0.857 0.429 N 0.925 Z: 8 4.542 1.913 0.652 0.325 0.714 0.143 CB 0.922 8 residues pruned to eliminate duplicates Z: 11 3.624 1.390 0.608 0.516 0.600 0.500 N 0.841 Z: 8 4.258 1.793 0.361 0.389 0.857 0.571 CB 0.865 Z: 13 18.604 1.800 0.482 0.839 1.000 0.583 CA 1.502 13 residues pruned to eliminate duplicates Z: 19 30.038 2.013 0.907 0.884 0.944 0.722 CB 1.411 19 residues pruned to eliminate duplicates Z: 8 3.323 1.599 0.956 0.213 0.571 0.571 CB 0.986 Z: 15 14.401 2.083 0.728 0.341 0.786 0.571 CB 1.618 5 residues pruned to eliminate duplicates Z: 19 28.483 1.938 0.992 0.892 0.944 0.778 CA 1.323 19 residues pruned to eliminate duplicates Z: 7 3.576 1.657 0.133 0.742 1.000 1.000 CB 0.626 Z: 7 2.670 1.500 0.244 0.412 0.833 0.667 N 0.768 Z: 8 5.179 1.710 0.719 0.481 1.000 0.571 CB 0.679 Z: 6 4.120 1.514 0.734 0.834 0.800 0.800 CA 0.658 6 residues pruned to eliminate duplicates Z: 20 20.788 1.725 0.521 0.843 0.947 0.684 CB 1.428 20 residues pruned to eliminate duplicates Z: 10 3.048 1.531 0.589 0.225 0.556 0.333 CB 1.037 Z: 22 25.175 1.851 0.633 0.833 1.000 0.810 CA 1.364 22 residues pruned to eliminate duplicates Z: 6 2.030 1.487 0.173 0.295 0.800 0.600 CB 0.819 Z: 12 7.414 1.900 0.367 0.357 0.909 0.455 CB 1.105 12 residues pruned to eliminate duplicates Z: 42 30.555 1.955 1.074 0.528 0.927 0.561 CB 1.235 42 residues pruned to eliminate duplicates Z: 6 5.159 1.600 0.541 0.538 0.800 0.600 CB 1.127 Z: 9 8.564 1.705 0.559 0.578 0.875 0.500 CB 1.208 9 residues pruned to eliminate duplicates Z: 11 3.394 1.613 0.326 0.281 0.600 0.400 CB 1.071 8 residues pruned to eliminate duplicates Z: 10 32.508 2.137 1.180 0.848 1.000 0.222 CB 1.725 10 residues pruned to eliminate duplicates Z: 6 8.058 1.708 0.931 0.778 1.000 0.800 CA 0.855 6 residues pruned to eliminate duplicates Z: 8 12.289 2.041 0.871 0.628 0.857 0.714 CB 1.258 7 residues pruned to eliminate duplicates Z: 18 11.697 2.041 0.835 0.373 0.706 0.412 CB 1.230 18 residues pruned to eliminate duplicates Z: 36 21.052 1.844 0.721 0.493 0.829 0.571 CB 1.363 36 residues pruned to eliminate duplicates Z: 26 14.498 1.965 0.573 0.415 0.880 0.680 CB 1.165 26 residues pruned to eliminate duplicates Z: 8 15.899 2.047 0.843 0.682 1.000 0.857 CB 1.348 8 residues pruned to eliminate duplicates Z: 23 50.782 2.348 1.004 0.934 1.000 0.864 CB 1.604 23 residues pruned to eliminate duplicates Z: 12 16.536 1.809 0.798 0.863 0.909 0.818 CA 1.237 12 residues pruned to eliminate duplicates Z: 19 20.526 1.890 0.620 0.878 0.944 0.778 CA 1.214 19 residues pruned to eliminate duplicates Z: 21 26.094 1.908 0.770 0.916 1.000 0.850 CA 1.220 21 residues pruned to eliminate duplicates Z: 20 35.878 1.912 1.221 0.869 0.947 0.737 CA 1.494 20 residues pruned to eliminate duplicates Z: 19 31.217 1.929 1.102 0.875 0.944 0.722 CB 1.397 19 residues pruned to eliminate duplicates Z: 9 3.039 1.584 0.456 0.238 0.625 0.500 CB 1.010 Z: 8 3.743 1.633 -0.126 0.398 0.857 0.571 CB 1.287 Z: 19 32.352 2.074 0.857 0.866 0.944 0.889 CA 1.535 19 residues pruned to eliminate duplicates Z: 9 8.078 1.625 0.548 0.765 0.875 0.625 CB 1.026 9 residues pruned to eliminate duplicates Z: 19 28.174 1.896 0.922 0.883 1.000 0.889 CA 1.318 19 residues pruned to eliminate duplicates Z: 26 25.516 2.104 1.016 0.453 0.880 0.640 CA 1.434 26 residues pruned to eliminate duplicates Z: 41 23.423 1.937 0.698 0.518 0.850 0.600 CB 1.302 41 residues pruned to eliminate duplicates Z: 7 4.816 1.546 0.795 0.409 0.667 0.000 CB 1.169 Z: 7 5.262 1.670 0.680 0.339 0.833 0.500 CB 1.096 5 residues pruned to eliminate duplicates Z: 8 11.615 1.767 0.536 0.815 0.857 0.714 N 1.435 8 residues pruned to eliminate duplicates Z: 8 2.543 1.634 0.802 0.071 0.571 0.286 CB 1.000 Z: 24 24.223 1.958 0.911 0.689 0.870 0.522 CB 1.306 24 residues pruned to eliminate duplicates Z: 6 9.506 1.968 0.663 0.850 1.000 0.600 CB 0.962 6 residues pruned to eliminate duplicates Z: 7 5.908 1.825 0.857 0.480 0.833 0.500 CB 0.872 Z: 13 25.791 1.945 1.169 0.833 1.000 0.417 CB 1.324 13 residues pruned to eliminate duplicates Z: 6 3.617 1.546 0.037 0.685 0.800 0.800 CB 1.064 Z: 25 52.456 2.304 1.302 0.908 1.000 0.792 CA 1.434 25 residues pruned to eliminate duplicates Z: 9 5.291 1.791 0.541 0.544 0.750 0.625 CB 0.866 Z: 12 22.430 1.800 0.931 0.869 1.000 0.727 CA 1.421 12 residues pruned to eliminate duplicates Z: 8 2.292 1.320 0.487 0.267 0.571 0.286 CB 1.007 8 residues pruned to eliminate duplicates Z: 58 32.182 2.017 0.636 0.541 0.860 0.596 CB 1.444 58 residues pruned to eliminate duplicates Z: 19 41.469 2.240 1.268 0.951 0.944 0.722 CA 1.404 19 residues pruned to eliminate duplicates 6 1.710 1.694 -0.212 0.471 0.800 0.600 CB 0.737 ? Z: 20 33.515 1.863 1.162 0.894 0.947 0.526 CA 1.445 20 residues pruned to eliminate duplicates Z: 15 17.278 2.107 0.845 0.468 0.929 0.643 CB 1.321 15 residues pruned to eliminate duplicates Z: 6 2.333 1.333 0.234 0.808 1.000 0.600 N 0.485 Z: 6 4.831 1.430 1.007 0.834 1.000 0.800 CB 0.565 Z: 17 21.290 2.051 0.819 0.911 0.938 0.938 CA 1.079 17 residues pruned to eliminate duplicates 6 1.692 1.581 0.319 0.292 0.600 0.400 CB 0.764 ? Z: 13 12.752 1.841 0.989 0.853 0.833 0.583 CB 0.892 Z: 12 7.627 2.073 0.521 0.361 0.636 0.364 CA 1.331 16 residues pruned to eliminate duplicates Z: 20 15.381 1.999 0.772 0.377 0.789 0.526 CA 1.438 20 residues pruned to eliminate duplicates Z: 18 35.853 2.134 1.360 0.910 0.824 0.471 CB 1.486 28 residues pruned to eliminate duplicates Z: 36 31.698 2.132 1.037 0.613 0.800 0.629 CB 1.385 36 residues pruned to eliminate duplicates Z: 10 10.576 1.730 0.577 0.803 0.778 0.556 CA 1.275 8 residues pruned to eliminate duplicates Z: 8 4.868 1.728 0.449 0.279 0.714 0.429 N 1.321 Z: 9 2.424 1.568 0.366 0.292 0.625 0.500 N 0.808 9 residues pruned to eliminate duplicates Z: 38 26.008 2.112 0.795 0.426 0.892 0.622 CA 1.367 38 residues pruned to eliminate duplicates Z: 6 4.903 1.556 1.033 0.736 0.600 0.600 N 0.935 5 residues pruned to eliminate duplicates Z: 20 31.195 2.057 0.789 0.861 1.000 0.842 CA 1.429 20 residues pruned to eliminate duplicates Z: 20 31.016 2.076 0.618 0.903 1.000 0.947 CA 1.509 20 residues pruned to eliminate duplicates Z: 20 10.389 1.785 0.438 0.393 0.895 0.579 CB 1.162 9 residues pruned to eliminate duplicates Z: 60 40.331 2.065 0.984 0.531 0.864 0.610 CB 1.438 57 residues pruned to eliminate duplicates Z: 8 3.724 1.490 0.566 0.283 0.714 0.429 CA 1.079 Z: 6 7.999 1.491 0.984 0.736 0.800 0.800 CA 1.223 Z: 22 28.441 2.270 0.867 0.797 0.857 0.810 CA 1.316 22 residues pruned to eliminate duplicates Z: 18 15.789 1.903 1.173 0.385 0.824 0.353 CB 1.270 18 residues pruned to eliminate duplicates Z: 14 11.305 1.832 0.705 0.345 0.769 0.692 O 1.545 14 residues pruned to eliminate duplicates Z: 9 11.090 1.715 0.617 0.831 0.750 0.750 CA 1.416 9 residues pruned to eliminate duplicates Z: 6 3.068 1.386 0.902 0.458 0.600 0.600 CB 0.905 Z: 6 5.377 1.534 0.486 0.595 0.800 0.200 CB 1.204 6 residues pruned to eliminate duplicates Z: 21 22.163 1.791 0.668 0.890 0.900 0.850 CB 1.326 21 residues pruned to eliminate duplicates 6 1.413 1.638 0.263 0.359 0.400 0.400 CB 0.889 ? Z: 10 15.003 1.700 0.792 0.816 0.889 0.667 CB 1.403 10 residues pruned to eliminate duplicates Z: 10 22.689 2.142 0.820 0.878 1.000 0.556 CB 1.408 9 residues pruned to eliminate duplicates Z: 18 11.003 2.029 0.544 0.352 0.941 0.471 CB 1.063 18 residues pruned to eliminate duplicates Z: 8 24.172 2.193 1.209 0.836 0.857 0.286 CA 1.646 8 residues pruned to eliminate duplicates Z: 24 46.391 2.284 0.912 0.926 0.957 0.826 CB 1.624 24 residues pruned to eliminate duplicates Z: 28 34.675 2.045 1.017 0.747 1.000 0.815 CB 1.298 28 residues pruned to eliminate duplicates Z: 24 33.287 2.319 0.481 0.924 1.000 0.870 CA 1.419 24 residues pruned to eliminate duplicates Z: 7 4.144 1.486 0.167 0.701 0.833 0.667 CB 0.975 Z: 38 14.064 1.781 0.734 0.327 0.811 0.486 CB 1.116 47 residues pruned to eliminate duplicates Z: 16 35.191 2.200 1.519 0.904 0.867 0.733 CA 1.347 16 residues pruned to eliminate duplicates Z: 20 46.231 2.119 1.308 0.902 1.000 0.474 CA 1.547 20 residues pruned to eliminate duplicates Z: 26 19.852 2.113 0.615 0.422 0.920 0.640 CB 1.371 26 residues pruned to eliminate duplicates Z: 11 2.771 1.567 0.612 0.174 0.600 0.400 CB 0.857 Z: 13 9.745 1.984 0.938 0.328 0.750 0.417 CB 1.178 13 residues pruned to eliminate duplicates Z: 12 14.763 1.888 0.407 0.829 0.909 0.818 CB 1.387 12 residues pruned to eliminate duplicates Z: 13 7.619 1.865 0.388 0.256 0.750 0.500 CA 1.498 13 residues pruned to eliminate duplicates Z: 20 22.913 2.127 1.084 0.456 0.895 0.579 CA 1.386 20 residues pruned to eliminate duplicates Z: 7 8.088 1.825 0.400 0.460 1.000 0.667 CB 1.346 Z: 19 9.002 1.792 0.314 0.285 0.833 0.556 CB 1.377 15 residues pruned to eliminate duplicates Z: 6 4.022 1.459 0.516 0.772 0.800 0.600 CB 0.799 6 residues pruned to eliminate duplicates Z: 9 7.016 1.884 0.532 0.288 0.750 0.500 CB 1.455 9 residues pruned to eliminate duplicates Z: 6 3.649 1.700 0.643 0.642 1.000 0.800 CB 0.512 Z: 7 7.524 1.439 1.301 0.448 1.000 0.500 CB 0.978 7 residues pruned to eliminate duplicates Z: 13 20.409 1.893 0.821 0.881 1.000 0.833 CB 1.238 13 residues pruned to eliminate duplicates Z: 21 10.475 1.682 0.647 0.370 0.750 0.450 CB 1.296 21 residues pruned to eliminate duplicates Z: 6 5.362 1.729 -0.043 0.829 1.000 0.800 CB 1.091 6 residues pruned to eliminate duplicates Z: 33 21.696 2.011 0.994 0.373 0.781 0.500 CA 1.402 33 residues pruned to eliminate duplicates Z: 9 6.450 1.741 0.222 0.420 0.875 0.625 CB 1.332 9 residues pruned to eliminate duplicates Z: 8 3.873 1.737 0.285 0.328 0.857 0.286 CB 0.924 Z: 11 16.603 1.817 1.181 0.762 0.900 0.600 CA 1.167 11 residues pruned to eliminate duplicates Z: 27 22.003 2.065 0.895 0.497 0.885 0.654 CA 1.250 27 residues pruned to eliminate duplicates Z: 45 43.413 2.181 0.795 0.649 0.977 0.727 CB 1.489 50 residues pruned to eliminate duplicates Z: 15 5.846 1.621 0.490 0.372 0.786 0.429 CB 0.944 15 residues pruned to eliminate duplicates Z: 7 8.198 2.040 0.209 0.757 0.833 0.500 CB 1.295 7 residues pruned to eliminate duplicates Z: 6 3.217 1.412 0.266 0.384 0.800 0.400 O 1.137 Z: 14 20.569 2.239 1.026 0.513 0.846 0.615 CB 1.467 14 residues pruned to eliminate duplicates Z: 26 42.972 2.371 0.888 0.868 0.960 0.800 CA 1.462 26 residues pruned to eliminate duplicates Z: 9 7.964 1.844 0.546 0.395 0.750 0.375 CB 1.471 10 residues pruned to eliminate duplicates Z: 15 24.466 2.278 0.853 0.520 1.000 0.786 CA 1.519 15 residues pruned to eliminate duplicates Z: 6 2.312 1.435 0.691 0.300 0.600 0.600 N 0.888 Z: 19 8.169 1.866 0.265 0.382 0.889 0.278 CA 1.041 19 residues pruned to eliminate duplicates Z: 6 7.102 1.898 0.950 0.732 1.000 0.800 CB 0.696 Z: 7 3.727 1.556 0.696 0.388 0.667 0.667 CB 0.974 Z: 18 24.917 1.833 0.600 0.909 1.000 0.941 CA 1.462 18 residues pruned to eliminate duplicates Z: 11 6.584 1.409 0.767 0.583 0.700 0.600 CB 1.103 Z: 8 9.915 1.762 0.538 0.765 0.857 0.714 CA 1.275 8 residues pruned to eliminate duplicates 8 1.338 1.407 -0.411 0.347 0.714 0.429 CB 1.010 ? Z: 26 54.377 2.281 1.337 0.867 1.000 0.760 CB 1.493 26 residues pruned to eliminate duplicates Z: 20 24.013 1.961 0.679 0.831 1.000 0.789 CA 1.257 20 residues pruned to eliminate duplicates Z: 24 44.541 2.250 1.118 0.881 0.957 0.739 CA 1.476 24 residues pruned to eliminate duplicates Z: 6 7.284 1.785 0.770 0.792 0.800 0.600 CB 0.998 6 residues pruned to eliminate duplicates Z: 10 3.397 1.509 0.871 0.315 0.778 0.556 CB 0.632 Z: 23 25.056 1.849 0.970 0.841 0.909 0.455 CB 1.203 19 residues pruned to eliminate duplicates Z: 7 10.065 1.936 1.197 0.603 0.833 0.833 CA 1.051 7 residues pruned to eliminate duplicates Z: 21 26.682 2.014 0.595 0.833 0.950 0.650 CA 1.467 21 residues pruned to eliminate duplicates Z: 17 24.757 1.998 0.854 0.857 1.000 1.000 CA 1.232 17 residues pruned to eliminate duplicates Z: 12 17.690 1.889 0.745 0.867 1.000 0.636 CA 1.184 12 residues pruned to eliminate duplicates Z: 9 3.487 1.528 0.422 0.306 0.625 0.375 N 1.126 Z: 9 3.947 1.458 0.562 0.305 0.625 0.625 O 1.217 Z: 7 3.958 1.710 0.177 0.389 0.833 0.667 CB 1.083 Z: 18 31.051 2.039 0.870 0.934 1.000 0.882 CB 1.377 18 residues pruned to eliminate duplicates Z: 6 8.346 1.826 0.946 0.472 0.800 0.600 CA 1.351 6 residues pruned to eliminate duplicates 7 0.709 1.614 0.336 0.515 0.833 0.500 CB 0.159 ? Z: 6 2.502 1.061 0.637 0.459 1.000 0.600 C 0.672 Z: 12 15.112 1.625 0.640 0.878 1.000 1.000 CA 1.241 12 residues pruned to eliminate duplicates Z: 7 14.241 1.762 1.070 0.859 1.000 0.667 CA 1.173 Z: 6 2.068 1.486 0.537 0.327 0.600 0.400 N 0.816 Z: 19 31.297 2.108 0.772 0.922 0.944 0.889 CA 1.470 19 residues pruned to eliminate duplicates Z: 6 2.540 1.434 0.359 0.280 0.800 0.600 CB 0.934 Z: 19 27.943 1.961 0.923 0.852 0.944 0.889 CA 1.368 19 residues pruned to eliminate duplicates Z: 21 17.138 1.999 0.749 0.474 0.850 0.600 CA 1.324 21 residues pruned to eliminate duplicates Z: 18 34.213 2.016 1.199 0.928 0.941 0.706 CB 1.392 18 residues pruned to eliminate duplicates Z: 28 27.732 2.083 1.073 0.472 0.815 0.407 CA 1.560 28 residues pruned to eliminate duplicates Z: 14 13.335 2.085 0.523 0.485 0.923 0.385 CB 1.282 14 residues pruned to eliminate duplicates Z: 10 8.311 1.871 0.910 0.178 1.000 0.333 CA 1.143 Z: 24 25.369 2.110 0.977 0.586 0.783 0.522 CA 1.492 16 residues pruned to eliminate duplicates Z: 13 9.647 1.893 0.552 0.482 0.833 0.667 CB 1.158 20 residues pruned to eliminate duplicates Z: 22 18.110 2.116 0.818 0.486 0.810 0.619 CB 1.287 24 residues pruned to eliminate duplicates Z: 6 3.457 1.638 0.657 0.299 0.600 0.600 N 1.189 Z: 20 26.794 1.802 0.916 0.816 1.000 0.789 CB 1.353 20 residues pruned to eliminate duplicates Z: 50 34.658 2.176 0.808 0.458 0.898 0.612 CB 1.463 50 residues pruned to eliminate duplicates Z: 12 20.964 1.783 0.957 0.864 1.000 0.818 CA 1.328 12 residues pruned to eliminate duplicates Z: 21 29.729 1.933 0.877 0.874 1.000 0.700 CB 1.333 21 residues pruned to eliminate duplicates Z: 10 13.024 2.002 0.976 0.698 0.778 0.556 CB 1.178 10 residues pruned to eliminate duplicates Z: 6 2.385 1.521 0.157 0.366 0.800 0.400 CB 0.875 Z: 21 21.329 1.758 0.619 0.833 0.950 0.600 CB 1.323 21 residues pruned to eliminate duplicates Z: 12 16.924 2.034 0.813 0.828 0.818 0.727 CB 1.274 12 residues pruned to eliminate duplicates Z: 8 8.615 1.648 0.591 0.723 0.714 0.429 C 1.422 8 residues pruned to eliminate duplicates Z: 36 32.840 2.230 0.917 0.506 0.943 0.629 CA 1.369 36 residues pruned to eliminate duplicates Z: 10 28.916 2.153 0.890 0.912 1.000 0.889 CB 1.678 10 residues pruned to eliminate duplicates Z: 22 40.755 2.420 0.520 0.899 1.000 0.905 CA 1.728 22 residues pruned to eliminate duplicates Z: 20 25.133 1.828 0.750 0.860 0.895 0.526 CB 1.481 20 residues pruned to eliminate duplicates Z: 6 6.018 1.638 0.576 0.520 0.800 0.400 CA 1.278 Z: 13 20.295 1.885 0.790 0.894 0.917 0.667 CA 1.359 13 residues pruned to eliminate duplicates Z: 6 3.370 1.404 0.316 0.509 0.800 0.600 CB 1.011 Z: 8 5.381 1.725 0.794 0.586 0.714 0.714 CB 0.847 Z: 7 8.440 1.780 0.433 0.765 0.833 0.667 CA 1.281 7 residues pruned to eliminate duplicates Z: 10 3.368 1.859 1.071 0.317 0.556 0.556 CB 0.643 Z: 7 4.652 1.939 0.194 0.479 0.833 0.500 CB 1.005 7 residues pruned to eliminate duplicates Z: 18 11.665 2.027 0.378 0.481 0.882 0.588 CB 1.170 18 residues pruned to eliminate duplicates Z: 13 10.645 1.868 0.599 0.561 0.833 0.583 CB 1.164 13 residues pruned to eliminate duplicates Z: 50 20.396 1.958 0.661 0.351 0.878 0.551 CB 1.199 50 residues pruned to eliminate duplicates Z: 7 5.190 1.710 0.353 0.503 0.833 0.667 CA 1.096 7 residues pruned to eliminate duplicates Z: 13 7.069 1.656 0.703 0.332 0.667 0.333 CB 1.304 13 residues pruned to eliminate duplicates Z: 11 2.980 1.400 0.466 0.308 0.700 0.400 CA 0.812 Z: 16 5.418 1.372 0.831 0.262 0.800 0.333 CB 0.913 Z: 26 41.993 2.241 1.339 0.691 0.880 0.600 CB 1.529 26 residues pruned to eliminate duplicates Z: 6 2.968 1.801 -0.027 0.449 0.800 0.600 CB 0.998 Z: 12 9.088 1.956 0.574 0.549 0.909 0.727 CB 0.933 12 residues pruned to eliminate duplicates Z: 34 45.874 2.177 1.283 0.676 0.939 0.576 CB 1.454 34 residues pruned to eliminate duplicates Z: 6 9.279 1.509 0.923 0.657 1.000 0.800 O 1.236 6 residues pruned to eliminate duplicates Z: 31 23.683 1.915 1.000 0.357 0.900 0.533 CB 1.464 15 residues pruned to eliminate duplicates Z: 18 27.955 2.020 1.261 0.903 0.941 0.765 CB 1.125 18 residues pruned to eliminate duplicates Z: 19 15.396 2.105 0.883 0.406 0.889 0.556 CB 1.137 19 residues pruned to eliminate duplicates Z: 9 8.927 1.619 0.344 0.656 1.000 0.750 CA 1.254 Z: 23 19.864 2.019 0.688 0.550 0.909 0.682 CB 1.302 12 residues pruned to eliminate duplicates Z: 10 3.609 1.613 0.840 0.347 0.556 0.333 CB 0.862 Z: 8 5.482 2.064 0.241 0.414 0.714 0.571 CB 1.239 Z: 11 12.868 1.797 0.674 0.888 1.000 0.600 CB 0.975 11 residues pruned to eliminate duplicates Z: 7 5.317 1.850 0.179 0.434 0.833 0.167 CB 1.279 6 residues pruned to eliminate duplicates Z: 22 24.901 1.712 0.700 0.845 1.000 0.667 CB 1.389 22 residues pruned to eliminate duplicates Z: 19 31.739 1.937 1.328 0.909 0.944 0.444 CB 1.247 19 residues pruned to eliminate duplicates Z: 10 6.617 1.973 0.404 0.360 0.778 0.556 CB 1.191 10 residues pruned to eliminate duplicates Z: 7 3.193 1.395 0.629 0.337 0.667 0.333 CA 1.028 Z: 14 20.733 2.062 0.641 0.538 1.000 0.615 CB 1.637 14 residues pruned to eliminate duplicates Z: 8 3.063 1.762 -0.067 0.519 0.714 0.571 CB 0.967 8 residues pruned to eliminate duplicates Z: 14 5.337 1.653 0.607 0.204 0.769 0.385 CB 1.029 14 residues pruned to eliminate duplicates Z: 7 3.693 1.589 0.576 0.425 0.667 0.333 CB 0.976 Z: 12 10.785 1.849 0.336 0.560 1.000 0.636 CB 1.242 12 residues pruned to eliminate duplicates Z: 7 3.419 1.334 0.061 0.763 1.000 1.000 CB 0.781 Z: 6 16.674 2.025 1.202 0.644 1.000 0.600 CA 1.461 6 residues pruned to eliminate duplicates Z: 15 15.086 2.022 0.779 0.457 0.929 0.357 CB 1.261 15 residues pruned to eliminate duplicates Z: 12 16.360 1.917 0.945 0.504 0.909 0.636 N 1.450 13 residues pruned to eliminate duplicates Z: 21 32.638 2.183 0.871 0.844 0.950 0.900 CA 1.399 21 residues pruned to eliminate duplicates Z: 10 16.335 2.085 1.462 0.580 0.778 0.556 CB 1.263 10 residues pruned to eliminate duplicates Z: 15 9.924 2.064 0.766 0.256 0.643 0.571 CA 1.497 15 residues pruned to eliminate duplicates Z: 10 11.545 2.039 0.780 0.383 0.889 0.333 CA 1.352 10 residues pruned to eliminate duplicates Z: 20 14.913 2.014 0.791 0.422 0.842 0.579 CB 1.221 20 residues pruned to eliminate duplicates Z: 11 3.654 1.306 0.674 0.364 0.800 0.300 N 0.765 Z: 26 15.848 1.846 0.656 0.436 0.800 0.520 CB 1.384 38 residues pruned to eliminate duplicates Z: 11 17.305 2.016 0.561 0.859 0.900 0.600 CB 1.423 11 residues pruned to eliminate duplicates Z: 7 5.112 1.525 0.811 0.709 0.833 0.500 CB 0.751 Z: 6 2.415 1.570 -0.190 0.668 0.800 0.800 CB 0.909 Z: 21 23.719 1.768 0.663 0.870 0.950 0.800 CB 1.386 21 residues pruned to eliminate duplicates Z: 21 23.134 1.865 0.667 0.921 1.000 1.000 CA 1.171 21 residues pruned to eliminate duplicates Z: 16 21.011 1.981 1.191 0.598 0.800 0.800 CB 1.423 16 residues pruned to eliminate duplicates Z: 23 16.510 1.971 0.954 0.412 0.864 0.500 CB 1.160 28 residues pruned to eliminate duplicates Z: 36 23.943 1.942 0.752 0.504 0.914 0.629 CB 1.295 36 residues pruned to eliminate duplicates Z: 11 5.194 1.808 0.377 0.300 0.700 0.600 CB 1.179 6 residues pruned to eliminate duplicates Z: 8 7.772 1.843 0.643 0.433 0.857 0.286 CB 1.213 8 residues pruned to eliminate duplicates Z: 18 13.335 1.991 0.852 0.368 0.824 0.353 CB 1.226 31 residues pruned to eliminate duplicates Z: 10 5.220 1.597 0.793 0.425 0.889 0.444 CB 0.739 10 residues pruned to eliminate duplicates Z: 48 59.562 2.246 1.182 0.708 0.936 0.489 CB 1.568 66 residues pruned to eliminate duplicates Z: 53 50.573 2.161 1.076 0.580 0.923 0.673 CA 1.568 53 residues pruned to eliminate duplicates Z: 7 8.069 1.697 0.537 0.808 1.000 0.833 CA 0.965 7 residues pruned to eliminate duplicates Z: 20 18.651 1.991 1.202 0.334 0.842 0.579 CB 1.390 18 residues pruned to eliminate duplicates Z: 22 25.349 1.791 0.696 0.891 0.905 0.667 CB 1.447 22 residues pruned to eliminate duplicates Z: 7 17.851 1.936 0.674 0.846 1.000 0.667 N 1.671 7 residues pruned to eliminate duplicates Z: 23 27.204 2.052 0.997 0.574 0.909 0.773 CB 1.450 23 residues pruned to eliminate duplicates Z: 9 5.653 1.830 0.284 0.339 0.750 0.375 N 1.351 8 residues pruned to eliminate duplicates Z: 20 25.856 2.076 0.564 0.902 1.000 0.895 CA 1.303 20 residues pruned to eliminate duplicates Z: 8 17.096 1.889 1.431 0.739 0.857 0.429 CA 1.325 8 residues pruned to eliminate duplicates Z: 11 2.346 1.459 0.171 0.341 0.600 0.500 CB 0.860 Z: 6 2.767 1.543 0.594 0.299 0.600 0.600 N 1.049 Z: 7 2.642 1.633 0.425 0.241 0.500 0.333 O 1.250 5 residues pruned to eliminate duplicates Z: 16 11.176 2.129 0.540 0.343 0.867 0.667 CB 1.205 16 residues pruned to eliminate duplicates Z: 12 15.379 1.879 0.866 0.597 0.818 0.727 CA 1.474 12 residues pruned to eliminate duplicates 7 1.400 1.558 0.364 0.083 0.667 0.333 CB 0.692 ? Z: 12 17.258 2.032 0.871 0.637 0.818 0.545 CB 1.471 11 residues pruned to eliminate duplicates Z: 7 4.210 1.510 0.599 0.313 0.833 0.500 CA 1.050 Z: 10 34.838 2.151 1.409 0.916 1.000 0.667 CB 1.583 10 residues pruned to eliminate duplicates Z: 19 47.548 2.310 1.637 0.883 1.000 0.611 CA 1.330 19 residues pruned to eliminate duplicates Z: 10 7.000 1.777 0.593 0.429 0.667 0.444 CA 1.332 10 residues pruned to eliminate duplicates Z: 19 26.850 1.891 0.948 0.884 1.000 0.611 CA 1.241 19 residues pruned to eliminate duplicates Z: 16 24.347 2.143 0.788 0.841 0.933 0.867 CB 1.311 16 residues pruned to eliminate duplicates Z: 18 11.234 1.879 0.520 0.388 0.765 0.471 CA 1.405 18 residues pruned to eliminate duplicates Z: 24 10.247 1.961 0.696 0.294 0.696 0.348 CB 1.163 24 residues pruned to eliminate duplicates Z: 13 11.864 1.864 0.518 0.484 0.917 0.750 CA 1.341 13 residues pruned to eliminate duplicates Z: 6 2.338 1.343 0.522 0.509 0.800 0.600 CB 0.634 Z: 19 23.502 1.885 0.582 0.894 0.889 0.667 CB 1.499 19 residues pruned to eliminate duplicates Z: 7 3.882 1.481 0.464 0.767 0.667 0.667 C 0.866 Z: 6 3.759 1.845 0.388 0.300 0.800 0.400 CB 1.026 6 1.520 1.234 0.551 0.296 0.600 0.400 C 0.743 ? Z: 18 21.212 1.736 0.801 0.839 0.941 0.706 CB 1.306 16 residues pruned to eliminate duplicates Z: 7 3.786 1.549 0.440 0.308 0.833 0.667 N 1.029 Z: 6 10.362 1.878 0.503 0.817 1.000 0.800 CB 1.246 6 1.162 1.228 0.457 0.230 0.600 0.200 CB 0.663 ? Z: 43 22.447 1.991 1.019 0.331 0.857 0.643 CB 1.211 43 residues pruned to eliminate duplicates Z: 7 2.762 1.473 0.590 0.278 0.667 0.333 N 0.928 Z: 6 5.226 1.472 1.136 0.616 0.800 0.600 CB 0.833 Z: 37 33.404 2.058 0.965 0.657 0.861 0.583 CB 1.382 37 residues pruned to eliminate duplicates Z: 6 2.340 1.488 0.002 0.570 0.800 0.600 CA 0.820 Z: 6 2.066 1.713 0.382 0.211 0.600 0.400 N 0.915 Z: 6 6.001 1.554 0.845 0.541 0.800 0.600 CA 1.124 Z: 18 12.055 1.826 0.780 0.357 0.824 0.412 CB 1.275 18 residues pruned to eliminate duplicates Z: 42 31.827 2.044 0.751 0.616 0.902 0.756 CB 1.379 42 residues pruned to eliminate duplicates Z: 7 11.768 1.691 1.250 0.817 0.833 0.667 N 1.150 7 residues pruned to eliminate duplicates Z: 7 6.410 1.894 0.645 0.491 0.833 0.500 CA 1.017 Z: 9 3.781 1.300 0.856 0.322 0.750 0.250 CB 0.899 Z: 7 4.035 1.531 0.719 0.387 0.667 0.500 CB 1.059 Z: 28 12.382 1.971 0.314 0.435 0.889 0.519 CB 1.106 28 residues pruned to eliminate duplicates Z: 11 11.442 1.983 0.403 0.442 0.900 0.700 CB 1.534 11 residues pruned to eliminate duplicates Z: 6 4.993 1.353 0.808 0.785 0.800 0.800 CA 0.888 6 residues pruned to eliminate duplicates Z: 7 3.145 1.494 0.075 0.404 0.833 0.667 CB 1.061 Z: 7 8.194 1.822 0.216 0.744 1.000 0.500 CA 1.214 7 residues pruned to eliminate duplicates Z: 7 6.040 1.591 0.251 0.649 1.000 0.500 CA 1.079 Z: 9 3.989 1.725 0.173 0.446 0.750 0.625 CB 0.983 Z: 13 7.295 1.637 0.809 0.509 0.667 0.500 CB 1.057 13 residues pruned to eliminate duplicates Z: 7 8.891 2.006 0.594 0.460 1.000 0.667 CB 1.183 7 residues pruned to eliminate duplicates 6 1.557 1.449 0.327 0.347 0.400 0.400 CB 1.069 ? Z: 6 3.921 1.179 1.010 0.555 0.800 0.800 O 0.877 Z: 8 6.809 1.840 0.534 0.464 0.857 0.714 CB 1.104 8 residues pruned to eliminate duplicates Z: 21 12.263 1.839 0.714 0.364 0.800 0.550 CB 1.259 21 residues pruned to eliminate duplicates Z: 28 37.268 2.141 0.942 0.687 0.963 0.778 CB 1.509 28 residues pruned to eliminate duplicates Z: 20 19.259 1.967 0.638 0.822 0.842 0.632 CA 1.232 20 residues pruned to eliminate duplicates Z: 6 3.630 1.783 0.495 0.492 0.800 0.600 CB 0.767 Z: 26 17.829 1.962 0.694 0.443 0.760 0.440 CB 1.498 26 residues pruned to eliminate duplicates Z: 6 2.761 1.353 0.641 0.317 0.800 0.600 CB 0.851 Z: 8 2.612 1.580 0.416 0.214 0.571 0.571 CB 1.082 Z: 8 16.683 2.181 0.714 0.454 1.000 0.857 CB 1.767 8 residues pruned to eliminate duplicates Z: 28 49.164 2.325 0.941 0.821 1.000 0.741 CA 1.588 28 residues pruned to eliminate duplicates 7 1.872 1.522 0.265 0.244 0.500 0.333 CB 1.066 ? Z: 9 10.404 1.858 0.748 0.591 0.750 0.625 CB 1.384 9 residues pruned to eliminate duplicates Z: 6 3.889 1.792 0.055 0.348 0.800 0.600 N 1.355 Z: 21 29.558 2.134 1.099 0.826 0.950 0.750 CA 1.172 21 residues pruned to eliminate duplicates Z: 19 14.166 1.874 0.966 0.329 0.944 0.722 CB 1.158 24 residues pruned to eliminate duplicates Z: 28 22.969 2.056 0.975 0.521 0.963 0.741 CB 1.107 28 residues pruned to eliminate duplicates Z: 19 35.669 1.974 1.230 0.936 1.000 0.556 CB 1.330 19 residues pruned to eliminate duplicates Z: 6 3.082 2.089 0.307 0.100 0.800 0.400 CB 1.052 6 residues pruned to eliminate duplicates 6 1.787 1.399 -0.318 0.576 1.000 0.600 CB 0.779 ? Z: 18 39.039 2.262 1.027 0.935 1.000 0.824 CA 1.439 18 residues pruned to eliminate duplicates Z: 14 15.702 2.180 0.550 0.913 0.923 0.846 CA 0.988 14 residues pruned to eliminate duplicates Z: 22 13.940 2.016 0.402 0.437 0.905 0.476 CB 1.269 22 residues pruned to eliminate duplicates Z: 14 10.918 2.031 0.622 0.323 0.846 0.462 CA 1.320 14 residues pruned to eliminate duplicates Z: 12 17.328 1.769 0.519 0.897 1.000 1.000 CA 1.392 12 residues pruned to eliminate duplicates Z: 6 2.998 1.455 0.473 0.335 1.000 0.400 CB 0.749 Z: 8 3.656 1.824 0.505 0.498 0.714 0.429 CA 0.707 Z: 12 3.299 1.378 0.550 0.324 0.818 0.545 CB 0.691 Z: 8 8.376 1.856 0.559 0.549 0.857 0.571 CB 1.217 5 residues pruned to eliminate duplicates Z: 11 19.443 1.966 0.906 0.894 1.000 0.900 CA 1.177 11 residues pruned to eliminate duplicates Z: 10 4.307 1.846 0.811 0.315 0.667 0.222 CA 0.790 7 1.780 1.454 -0.088 0.639 0.667 0.667 CB 0.722 ? Z: 19 28.820 1.903 0.910 0.868 1.000 0.722 CB 1.366 19 residues pruned to eliminate duplicates Z: 7 5.608 1.604 0.943 0.636 0.833 0.500 CA 0.776 7 residues pruned to eliminate duplicates Z: 46 22.939 1.943 0.769 0.392 0.822 0.644 CB 1.357 83 residues pruned to eliminate duplicates Z: 12 14.030 2.159 0.536 0.816 1.000 1.000 CA 0.969 12 residues pruned to eliminate duplicates Z: 6 3.341 1.430 0.884 0.676 0.800 0.600 CB 0.590 Z: 9 5.077 1.598 0.187 0.438 0.875 0.375 CB 1.153 Z: 8 2.753 1.670 0.226 0.327 0.714 0.429 CB 0.861 Z: 9 8.115 1.696 0.611 0.544 0.875 0.500 N 1.150 6 1.373 1.126 0.899 0.361 0.600 0.600 N 0.556 ? Z: 9 8.279 1.945 0.380 0.512 0.875 0.750 CB 1.232 9 residues pruned to eliminate duplicates Z: 7 2.567 1.831 0.705 0.224 0.833 0.333 CB 0.556 Z: 53 40.908 2.120 0.834 0.553 0.923 0.654 CA 1.501 53 residues pruned to eliminate duplicates Z: 9 4.846 1.451 0.979 0.375 0.750 0.375 N 0.909 Z: 27 29.217 2.092 1.012 0.574 0.846 0.577 CA 1.497 27 residues pruned to eliminate duplicates Z: 14 14.390 1.737 0.538 0.725 0.846 0.769 O 1.442 14 residues pruned to eliminate duplicates Z: 9 2.670 1.876 0.498 0.187 0.500 0.375 CB 0.979 9 residues pruned to eliminate duplicates Z: 9 7.019 1.610 0.804 0.438 1.000 0.500 CB 0.911 Z: 29 27.644 2.036 0.749 0.638 0.821 0.536 CB 1.570 29 residues pruned to eliminate duplicates Z: 9 15.339 1.822 1.138 0.875 0.875 0.875 CA 1.157 Z: 9 3.187 1.389 0.767 0.329 0.625 0.375 CB 0.887 Z: 6 2.604 1.420 0.523 0.413 0.800 0.400 CB 0.737 Z: 13 10.505 2.030 1.080 0.166 0.833 0.500 CB 1.294 14 residues pruned to eliminate duplicates Z: 6 3.544 1.697 0.506 0.820 0.800 0.600 CB 0.587 6 residues pruned to eliminate duplicates Z: 18 21.743 1.852 0.669 0.843 0.941 0.765 CB 1.350 18 residues pruned to eliminate duplicates Z: 15 24.046 1.881 0.873 0.888 1.000 0.786 CB 1.315 15 residues pruned to eliminate duplicates Z: 11 3.238 1.426 0.182 0.266 0.800 0.400 CB 0.991 Z: 17 11.311 1.859 0.428 0.486 0.875 0.500 CB 1.234 17 residues pruned to eliminate duplicates Z: 35 20.829 1.905 0.594 0.532 0.794 0.559 CB 1.436 35 residues pruned to eliminate duplicates Z: 9 4.041 1.497 0.310 0.382 0.875 0.500 CB 0.944 Z: 11 20.009 1.791 1.029 0.844 0.900 0.600 CA 1.440 11 residues pruned to eliminate duplicates Z: 13 4.436 1.616 0.273 0.228 0.750 0.333 CB 1.141 Z: 7 3.233 1.673 0.245 0.427 0.667 0.333 CB 1.026 Z: 10 15.277 1.922 0.857 0.658 1.000 0.889 CB 1.232 Z: 6 4.611 1.565 0.847 0.447 1.000 0.800 CB 0.753 Z: 8 4.162 1.370 0.573 0.457 0.857 0.571 CB 0.890 Z: 8 12.160 1.749 0.896 0.756 1.000 0.857 CA 1.103 8 residues pruned to eliminate duplicates Z: 13 8.401 1.745 0.656 0.324 0.833 0.417 CB 1.222 16 residues pruned to eliminate duplicates 6 1.683 1.266 0.214 0.297 0.800 0.600 CB 0.769 ? Z: 7 3.954 1.589 0.462 0.394 0.833 0.333 CB 0.933 Z: 7 3.976 1.536 0.910 0.499 0.500 0.500 CA 1.107 Z: 8 3.861 1.556 0.355 0.253 0.857 0.429 CB 1.073 8 residues pruned to eliminate duplicates Z: 9 6.373 1.960 0.944 0.371 0.500 0.250 CB 1.358 9 residues pruned to eliminate duplicates Z: 11 4.996 1.641 0.478 0.167 0.800 0.400 CB 1.220 11 residues pruned to eliminate duplicates Z: 8 2.356 1.601 0.512 0.357 0.714 0.714 CB 0.600 Z: 7 4.227 1.423 0.204 0.589 1.000 0.500 CB 0.925 Z: 19 37.029 2.159 0.962 0.909 1.000 0.500 CB 1.462 19 residues pruned to eliminate duplicates Z: 9 14.321 1.713 0.911 0.781 1.000 0.750 CA 1.207 9 residues pruned to eliminate duplicates Z: 7 3.235 1.631 -0.038 0.457 0.833 0.333 CB 1.055 Z: 9 3.253 1.544 0.426 0.588 0.875 0.625 N 0.549 Z: 11 27.225 1.974 1.079 0.909 1.000 0.700 CB 1.489 9 residues pruned to eliminate duplicates Z: 14 11.586 1.709 0.936 0.592 0.769 0.538 CB 1.157 14 residues pruned to eliminate duplicates Z: 21 23.420 2.130 1.251 0.437 0.900 0.500 CA 1.296 21 residues pruned to eliminate duplicates Z: 16 12.650 1.951 0.742 0.336 0.933 0.600 CB 1.232 12 residues pruned to eliminate duplicates Z: 26 24.687 2.130 0.612 0.708 0.880 0.760 CB 1.353 26 residues pruned to eliminate duplicates Z: 23 41.355 2.326 0.807 0.888 0.955 0.773 CB 1.583 23 residues pruned to eliminate duplicates Z: 9 14.402 1.713 1.304 0.822 0.875 0.750 CB 1.116 9 residues pruned to eliminate duplicates Z: 9 6.398 1.807 0.549 0.272 0.875 0.500 CB 1.197 9 residues pruned to eliminate duplicates Z: 12 8.034 1.655 0.590 0.441 0.818 0.455 CA 1.195 12 residues pruned to eliminate duplicates Z: 6 13.370 1.973 0.976 0.771 1.000 0.600 CB 1.206 6 residues pruned to eliminate duplicates Z: 8 3.897 1.517 0.780 0.241 0.714 0.571 N 1.031 Z: 14 12.228 2.193 0.853 0.397 0.692 0.615 CA 1.345 14 residues pruned to eliminate duplicates Z: 6 4.870 1.207 1.267 0.605 1.000 0.600 CB 0.720 Z: 6 4.124 1.497 0.471 0.592 0.800 0.400 CA 0.958 Z: 11 18.359 1.836 0.628 0.812 1.000 0.400 CA 1.480 11 residues pruned to eliminate duplicates Z: 10 11.354 1.623 0.724 0.815 1.000 0.778 CA 1.028 10 residues pruned to eliminate duplicates Z: 27 31.487 1.913 1.089 0.726 0.923 0.615 CB 1.365 27 residues pruned to eliminate duplicates Z: 20 41.627 2.081 1.245 0.915 1.000 0.737 CB 1.444 20 residues pruned to eliminate duplicates Z: 8 4.945 1.372 0.445 0.347 1.000 0.286 N 1.113 Z: 63 39.310 2.071 0.764 0.531 0.887 0.645 CB 1.494 63 residues pruned to eliminate duplicates 7 1.361 1.317 0.956 0.402 0.500 0.333 CB 0.478 ? Z: 17 38.115 2.224 1.138 0.746 1.000 0.812 CA 1.608 17 residues pruned to eliminate duplicates Z: 14 15.222 2.055 0.776 0.471 0.923 0.615 CB 1.291 14 residues pruned to eliminate duplicates Z: 17 10.715 1.625 0.887 0.450 0.750 0.562 CB 1.226 17 residues pruned to eliminate duplicates Z: 6 2.143 1.284 0.160 0.609 1.000 0.600 CB 0.580 Z: 25 16.602 1.956 0.990 0.376 0.750 0.583 CB 1.324 21 residues pruned to eliminate duplicates Z: 28 41.426 2.290 1.077 0.662 0.926 0.704 CA 1.558 28 residues pruned to eliminate duplicates Z: 8 4.629 1.296 0.326 0.622 0.857 0.571 N 1.058 7 1.945 1.295 0.360 0.373 0.833 0.500 CB 0.619 ? Z: 6 4.996 1.489 0.789 0.271 1.000 1.000 O 1.087 Z: 20 23.279 1.825 1.169 0.746 0.947 0.737 CB 1.143 20 residues pruned to eliminate duplicates Z: 6 2.570 1.458 0.149 0.384 0.800 0.600 CB 0.970 Z: 10 6.535 1.506 0.896 0.383 0.778 0.556 N 1.112 Z: 11 4.900 1.770 0.368 0.291 0.700 0.600 CB 1.156 Z: 11 17.284 1.841 1.063 0.923 0.900 0.500 CB 1.124 11 residues pruned to eliminate duplicates Z: 9 6.492 1.602 1.236 0.535 0.875 0.375 CB 0.708 9 residues pruned to eliminate duplicates Z: 6 6.143 1.749 0.358 0.523 1.000 0.800 CB 1.131 Z: 6 2.689 1.603 0.790 0.100 0.800 0.400 CB 0.873 Z: 21 11.869 1.970 0.544 0.248 0.900 0.550 CB 1.297 21 residues pruned to eliminate duplicates Z: 6 4.648 1.707 0.410 0.460 0.800 0.400 CB 1.124 Z: 29 37.197 2.225 1.406 0.503 0.893 0.643 CA 1.466 29 residues pruned to eliminate duplicates Z: 8 3.761 1.840 0.645 0.826 0.857 0.714 CB 0.413 Z: 7 8.941 1.506 0.470 0.843 1.000 0.667 CB 1.227 Z: 11 7.266 1.934 0.256 0.388 1.000 0.700 CB 1.064 11 residues pruned to eliminate duplicates Z: 25 18.178 1.994 0.977 0.399 0.833 0.542 CA 1.256 25 residues pruned to eliminate duplicates Z: 8 4.747 1.746 0.498 0.298 0.571 0.143 O 1.506 Z: 13 7.816 1.858 1.076 0.326 0.500 0.500 CA 1.417 9 residues pruned to eliminate duplicates Z: 8 3.982 1.476 0.857 0.416 0.571 0.571 CB 1.049 Z: 6 2.781 1.303 0.826 0.423 0.800 0.600 N 0.708 Z: 17 30.229 1.986 0.913 0.905 0.938 0.875 CA 1.511 17 residues pruned to eliminate duplicates Z: 10 24.141 1.883 1.100 0.907 1.000 0.889 CA 1.446 10 residues pruned to eliminate duplicates Z: 9 5.798 1.424 0.694 0.473 0.875 0.625 N 0.999 Z: 22 24.020 2.069 0.540 0.664 0.952 0.667 CA 1.484 22 residues pruned to eliminate duplicates Z: 7 7.871 1.937 0.593 0.861 0.833 0.667 CA 0.919 Z: 10 13.803 1.855 0.660 0.751 0.889 0.778 CB 1.344 10 residues pruned to eliminate duplicates Z: 7 4.700 1.495 0.281 0.560 0.833 0.667 CA 1.134 Z: 9 3.338 1.622 0.810 0.314 0.625 0.375 CB 0.790 Z: 15 8.977 1.723 0.440 0.426 0.857 0.357 CA 1.218 15 residues pruned to eliminate duplicates Z: 14 22.810 1.836 0.771 0.851 1.000 0.846 CA 1.440 14 residues pruned to eliminate duplicates Z: 12 12.319 2.039 0.472 0.453 0.909 0.545 CB 1.429 12 residues pruned to eliminate duplicates Z: 6 3.507 1.429 0.392 0.501 1.000 0.800 CB 0.788 Z: 19 24.538 1.936 0.858 0.915 0.944 0.889 CA 1.203 19 residues pruned to eliminate duplicates Z: 21 24.823 1.740 0.830 0.887 0.950 0.700 CA 1.323 44 residues pruned to eliminate duplicates Z: 36 46.004 2.225 1.244 0.716 0.857 0.771 CB 1.494 36 residues pruned to eliminate duplicates Z: 7 8.590 1.991 0.765 0.403 0.833 0.833 CB 1.326 7 residues pruned to eliminate duplicates Z: 6 4.136 1.656 0.447 0.723 0.600 0.400 CB 1.052 6 residues pruned to eliminate duplicates Z: 21 41.877 2.368 1.535 0.751 0.900 0.400 CB 1.385 21 residues pruned to eliminate duplicates Z: 21 14.730 1.812 0.554 0.430 0.950 0.600 CB 1.324 19 residues pruned to eliminate duplicates Z: 14 13.995 1.854 0.379 0.590 0.923 0.615 CB 1.509 14 residues pruned to eliminate duplicates Z: 19 25.423 1.758 1.061 0.826 1.000 0.500 CB 1.247 19 residues pruned to eliminate duplicates Z: 18 11.393 1.985 0.820 0.228 0.765 0.647 CB 1.374 18 residues pruned to eliminate duplicates Z: 6 3.918 1.602 0.815 0.420 0.800 0.600 CB 0.819 Z: 6 4.498 1.677 0.570 0.394 1.000 0.600 CA 0.854 Z: 10 4.258 1.654 0.554 0.371 0.778 0.556 CB 0.815 8 residues pruned to eliminate duplicates Z: 9 7.671 1.578 0.532 0.756 0.875 0.750 CB 1.021 9 residues pruned to eliminate duplicates Z: 22 19.880 1.783 0.716 0.712 0.905 0.571 CB 1.293 22 residues pruned to eliminate duplicates 6 1.981 1.526 0.918 0.299 0.600 0.600 CB 0.632 ? Z: 18 43.764 2.240 1.315 0.892 0.941 0.529 CA 1.562 18 residues pruned to eliminate duplicates Z: 8 3.838 1.385 0.768 0.422 0.857 0.429 CB 0.750 Z: 8 7.419 1.793 0.331 0.789 1.000 0.857 CB 0.911 Z: 23 20.478 1.916 0.652 0.673 0.818 0.682 CA 1.438 23 residues pruned to eliminate duplicates Z: 7 7.849 1.962 1.106 0.358 0.833 0.667 CA 1.085 Z: 14 23.186 2.046 0.772 0.794 0.923 0.923 CA 1.485 14 residues pruned to eliminate duplicates Z: 7 4.865 1.571 0.595 0.262 1.000 0.333 CB 1.041 Z: 24 25.913 2.043 0.997 0.529 0.913 0.652 CA 1.410 36 residues pruned to eliminate duplicates Z: 33 27.660 2.114 0.792 0.463 0.938 0.688 CA 1.429 33 residues pruned to eliminate duplicates Z: 11 12.268 1.779 0.713 0.718 0.800 0.800 CA 1.306 Z: 20 16.592 1.814 0.925 0.489 0.895 0.474 CB 1.232 13 residues pruned to eliminate duplicates Z: 16 8.062 1.791 0.412 0.326 0.733 0.467 CB 1.359 20 residues pruned to eliminate duplicates Z: 6 5.339 1.437 0.862 0.757 1.000 0.600 CB 0.710 Z: 22 55.658 2.399 1.119 0.934 1.000 0.667 CA 1.666 22 residues pruned to eliminate duplicates Z: 7 4.661 1.448 0.993 0.531 0.833 0.500 CA 0.767 8 residues pruned to eliminate duplicates 6 1.166 1.423 0.433 0.100 0.400 0.200 CA 1.065 ? Z: 26 20.216 1.850 0.696 0.610 0.840 0.600 CB 1.382 26 residues pruned to eliminate duplicates Z: 18 32.719 1.992 1.191 0.927 0.941 0.647 CB 1.354 18 residues pruned to eliminate duplicates Z: 11 4.349 1.908 0.234 0.308 0.700 0.500 CB 1.033 11 residues pruned to eliminate duplicates Z: 18 10.492 1.807 0.667 0.453 0.765 0.588 CB 1.160 18 residues pruned to eliminate duplicates 6 1.792 1.566 0.936 0.100 0.600 0.400 CB 0.734 ? Z: 20 45.941 2.139 1.314 0.866 0.947 0.632 CA 1.646 20 residues pruned to eliminate duplicates Z: 7 9.128 1.738 0.904 0.543 1.000 0.667 CA 1.080 Z: 6 7.421 1.508 0.824 0.503 1.000 0.600 O 1.203 Z: 6 2.871 1.398 0.309 0.338 0.800 0.600 N 1.046 Z: 18 24.315 2.176 1.239 0.408 0.824 0.588 CB 1.620 18 residues pruned to eliminate duplicates Z: 6 2.413 1.182 0.647 0.534 1.000 0.800 CB 0.536 Z: 8 3.359 1.643 0.093 0.349 0.714 0.429 CB 1.165 8 residues pruned to eliminate duplicates Z: 6 5.415 1.942 0.645 0.411 0.600 0.400 O 1.387 Z: 7 8.183 1.831 1.136 0.196 0.833 0.333 O 1.473 7 residues pruned to eliminate duplicates Z: 8 7.948 1.764 0.465 0.843 0.714 0.429 CB 1.212 8 residues pruned to eliminate duplicates Z: 10 4.220 1.591 0.774 0.428 0.778 0.556 CB 0.691 Z: 7 7.719 1.751 0.385 0.449 1.000 0.333 CB 1.369 7 residues pruned to eliminate duplicates Z: 6 9.722 1.952 0.951 0.553 1.000 0.400 CB 1.084 6 residues pruned to eliminate duplicates Z: 19 47.295 2.353 1.116 0.881 1.000 0.833 CA 1.621 19 residues pruned to eliminate duplicates Z: 6 2.216 1.449 0.297 0.389 0.600 0.400 CB 0.989 Z: 13 22.436 1.921 1.095 0.883 1.000 0.833 CA 1.163 11 residues pruned to eliminate duplicates Z: 24 28.468 2.134 1.195 0.507 0.870 0.609 CA 1.447 24 residues pruned to eliminate duplicates Z: 11 3.720 1.666 0.454 0.323 0.600 0.400 CB 0.983 4 residues pruned to eliminate duplicates Z: 10 7.451 1.557 0.713 0.378 0.889 0.667 C 1.193 Z: 10 3.316 1.556 0.378 0.218 0.778 0.333 N 0.923 Z: 26 25.741 2.041 0.512 0.682 0.960 0.720 CA 1.470 26 residues pruned to eliminate duplicates Z: 32 13.140 1.846 0.557 0.404 0.871 0.323 CB 1.043 32 residues pruned to eliminate duplicates Z: 10 10.398 1.660 0.593 0.583 1.000 0.667 CB 1.211 Z: 8 7.672 1.783 0.699 0.445 0.857 0.571 CB 1.182 Z: 44 26.570 1.952 0.667 0.576 0.977 0.698 CB 1.185 46 residues pruned to eliminate duplicates 1544 residues left after pruning, divided into chains as follows: A: 6 B: 14 C: 23 D: 84 E: 22 F: 16 G: 6 H: 7 I: 21 J: 42 K: 97 L: 19 M: 32 N: 172 O: 48 P: 80 Q: 125 R: 26 S: 45 T: 19 U: 8 V: 17 W: 6 X: 28 Y: 17 Z: 92 Z: 10 Z: 23 Z: 14 Z: 10 Z: 131 Z: 82 Z: 27 Z: 8 Z: 91 Z: 64 Z: 12 Residues blocked in groups of 7 to fit allocated memory (-u) CC for partial structure against native data = 31.54 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 1.067, Connect. = 0.782 for dens.mod. cycle 1 = 0.300, Contrast = 1.193, Connect. = 0.799 for dens.mod. cycle 2 = 0.300, Contrast = 1.447, Connect. = 0.816 for dens.mod. cycle 3 = 0.300, Contrast = 1.451, Connect. = 0.816 for dens.mod. cycle 4 = 0.300, Contrast = 1.451, Connect. = 0.816 for dens.mod. cycle 5 = 0.300, Contrast = 1.430, Connect. = 0.816 for dens.mod. cycle 6 = 0.300, Contrast = 1.416, Connect. = 0.816 for dens.mod. cycle 7 = 0.300, Contrast = 1.399, Connect. = 0.816 for dens.mod. cycle 8 = 0.300, Contrast = 1.385, Connect. = 0.816 for dens.mod. cycle 9 = 0.300, Contrast = 1.370, Connect. = 0.816 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 16731 peaks > 0.5 sigma used to seed fragment search Space for about 6134 unique residues taking solvent into account 2513 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 23 63.866 2.607 1.350 0.879 0.909 0.409 CB 1.774 B: 25 82.257 2.755 1.231 0.936 0.958 0.875 CA 1.984 C: 25 73.326 2.543 1.472 0.883 0.917 0.458 CA 1.878 D: 15 39.506 2.589 0.684 0.888 1.000 0.714 CA 1.745 15 residues pruned to eliminate duplicates E: 18 50.316 2.601 1.007 0.885 0.941 0.824 CA 1.793 F: 23 65.262 2.801 0.935 0.949 1.000 0.773 CA 1.771 21 residues pruned to eliminate duplicates G: 24 59.905 2.744 0.793 0.917 1.000 0.870 CA 1.792 18 residues pruned to eliminate duplicates H: 27 46.052 2.484 0.998 0.849 0.923 0.808 CA 1.461 25 residues pruned to eliminate duplicates I: 25 56.085 2.616 1.070 0.916 0.958 0.917 CA 1.558 25 residues pruned to eliminate duplicates J: 25 63.549 2.612 1.012 0.910 1.000 0.875 CA 1.750 25 residues pruned to eliminate duplicates K: 15 37.273 2.562 0.763 0.831 0.857 0.714 CA 1.934 16 residues pruned to eliminate duplicates L: 25 73.918 2.781 1.134 0.891 0.958 0.792 CA 1.908 M: 23 60.551 2.850 0.774 0.930 0.955 0.864 CA 1.870 23 residues pruned to eliminate duplicates N: 16 39.685 2.882 0.456 0.941 1.000 0.867 CA 1.695 O: 29 66.189 2.641 1.097 0.814 0.964 0.714 CA 1.782 29 residues pruned to eliminate duplicates P: 20 40.071 2.701 0.482 0.900 1.000 0.895 CA 1.640 16 residues pruned to eliminate duplicates Q: 24 72.616 2.749 1.396 0.899 0.870 0.391 CA 1.890 24 residues pruned to eliminate duplicates R: 22 35.973 2.401 0.715 0.886 0.952 0.857 CA 1.445 S: 19 39.802 2.506 0.559 0.896 0.944 0.778 CA 1.821 T: 27 61.623 2.642 1.175 0.839 0.923 0.808 CA 1.701 27 residues pruned to eliminate duplicates U: 21 61.424 2.658 1.103 0.877 0.950 0.650 CB 1.878 21 residues pruned to eliminate duplicates V: 49 42.387 2.514 0.647 0.482 0.896 0.604 CB 1.679 W: 20 55.109 2.708 1.160 0.883 0.895 0.737 CA 1.746 20 residues pruned to eliminate duplicates X: 25 69.298 2.582 1.260 0.869 1.000 0.500 CA 1.770 25 residues pruned to eliminate duplicates Y: 18 14.739 2.301 0.555 0.398 0.824 0.529 CB 1.351 Z: 19 59.021 2.725 0.894 0.910 1.000 0.833 CA 1.911 Z: 26 54.608 2.588 0.921 0.842 1.000 0.760 CA 1.636 27 residues pruned to eliminate duplicates Z: 26 59.164 2.556 1.172 0.903 0.960 0.680 CA 1.582 26 residues pruned to eliminate duplicates Z: 7 12.697 2.484 0.799 0.532 0.833 0.667 CB 1.350 7 residues pruned to eliminate duplicates Z: 10 19.743 2.242 0.651 0.851 0.889 0.667 CA 1.480 Z: 18 62.623 2.859 1.165 0.927 0.941 0.824 CA 1.827 22 residues pruned to eliminate duplicates Z: 20 47.987 2.563 0.766 0.914 1.000 0.947 CA 1.720 20 residues pruned to eliminate duplicates Z: 24 65.865 2.711 1.104 0.902 1.000 0.783 CA 1.717 24 residues pruned to eliminate duplicates Z: 19 52.036 2.682 0.889 0.928 1.000 0.778 CA 1.695 19 residues pruned to eliminate duplicates Z: 9 27.947 2.410 1.137 0.679 0.875 0.750 CA 1.860 10 residues pruned to eliminate duplicates Z: 19 42.794 2.643 0.839 0.896 0.889 0.833 CA 1.673 19 residues pruned to eliminate duplicates Z: 27 50.670 2.632 1.021 0.860 1.000 0.615 CA 1.374 Z: 23 56.353 2.797 0.875 0.945 1.000 0.955 CA 1.586 23 residues pruned to eliminate duplicates Z: 10 11.078 2.384 0.369 0.365 0.889 0.333 CB 1.471 Z: 18 41.060 2.529 0.992 0.807 0.824 0.588 CA 1.836 18 residues pruned to eliminate duplicates Z: 20 40.626 2.597 0.493 0.943 1.000 1.000 CA 1.665 20 residues pruned to eliminate duplicates Z: 67 69.761 2.595 0.931 0.629 0.879 0.652 CB 1.728 26 residues pruned to eliminate duplicates Z: 10 21.740 2.253 0.870 0.866 1.000 0.889 CA 1.259 9 residues pruned to eliminate duplicates Z: 26 61.765 2.746 0.812 0.928 1.000 0.680 CA 1.738 25 residues pruned to eliminate duplicates Z: 48 51.597 2.635 0.710 0.466 0.936 0.681 CB 1.846 18 residues pruned to eliminate duplicates Z: 24 64.958 2.857 0.745 0.934 1.000 0.913 CA 1.894 24 residues pruned to eliminate duplicates Z: 134 121.195 2.610 1.005 0.632 0.947 0.662 CB 1.872 37 residues pruned to eliminate duplicates Z: 20 41.902 2.656 0.468 0.912 1.000 0.947 CA 1.745 20 residues pruned to eliminate duplicates Z: 18 73.266 2.779 1.357 0.920 0.941 0.588 CA 2.030 18 residues pruned to eliminate duplicates Z: 11 22.353 2.447 0.442 0.903 0.900 0.900 CA 1.587 11 residues pruned to eliminate duplicates Z: 24 66.193 2.847 0.941 0.878 0.913 0.783 CA 1.986 24 residues pruned to eliminate duplicates Z: 25 66.056 2.781 1.105 0.916 0.875 0.417 CA 1.859 25 residues pruned to eliminate duplicates Z: 9 25.381 2.541 0.742 0.888 0.875 0.500 CA 1.670 9 residues pruned to eliminate duplicates Z: 16 48.120 2.936 0.679 0.938 0.933 0.600 CA 1.879 16 residues pruned to eliminate duplicates Z: 29 58.921 2.541 1.099 0.815 0.893 0.643 CA 1.779 24 residues pruned to eliminate duplicates Z: 23 83.640 2.782 1.448 0.898 0.955 0.545 CA 1.962 28 residues pruned to eliminate duplicates Z: 18 50.293 2.637 1.107 0.893 0.941 0.706 CA 1.674 Z: 10 22.913 2.252 0.944 0.865 0.778 0.778 CB 1.643 Z: 27 70.321 2.640 1.141 0.907 0.962 0.692 CA 1.804 27 residues pruned to eliminate duplicates Z: 21 69.266 2.563 1.372 0.923 0.950 0.800 CA 1.885 21 residues pruned to eliminate duplicates Z: 19 45.407 2.688 0.456 0.939 1.000 1.000 CA 1.900 18 residues pruned to eliminate duplicates Z: 21 28.510 2.349 0.271 0.880 0.950 0.750 CA 1.629 21 residues pruned to eliminate duplicates Z: 27 57.808 2.683 0.964 0.805 0.962 0.769 CA 1.715 24 residues pruned to eliminate duplicates Z: 26 64.479 2.705 1.225 0.858 0.840 0.520 CB 1.879 26 residues pruned to eliminate duplicates Z: 13 17.482 2.335 0.285 0.838 0.917 0.750 CB 1.371 Z: 20 47.651 2.759 0.777 0.890 1.000 0.842 CA 1.604 20 residues pruned to eliminate duplicates Z: 24 59.387 2.711 0.927 0.889 0.913 0.565 CA 1.869 25 residues pruned to eliminate duplicates Z: 24 79.027 2.745 1.294 0.895 0.957 0.826 CA 1.961 24 residues pruned to eliminate duplicates Z: 24 71.258 2.751 1.128 0.915 1.000 0.652 CA 1.795 24 residues pruned to eliminate duplicates Z: 21 48.790 2.663 1.327 0.774 0.800 0.450 CA 1.727 21 residues pruned to eliminate duplicates Z: 67 58.973 2.638 0.652 0.574 0.924 0.697 CB 1.677 68 residues pruned to eliminate duplicates Z: 26 59.776 2.715 1.096 0.890 1.000 0.680 CA 1.512 26 residues pruned to eliminate duplicates Z: 51 47.850 2.541 0.695 0.482 0.940 0.560 CB 1.703 51 residues pruned to eliminate duplicates Z: 18 59.413 2.877 0.919 0.932 1.000 0.882 CA 1.823 19 residues pruned to eliminate duplicates Z: 24 75.114 2.866 1.101 0.891 0.913 0.609 CA 2.048 24 residues pruned to eliminate duplicates Z: 19 64.257 2.733 0.951 0.926 1.000 0.778 CA 1.992 20 residues pruned to eliminate duplicates Z: 10 25.298 2.335 0.724 0.848 0.889 0.778 CA 1.748 Z: 20 42.687 2.487 1.012 0.854 0.947 0.684 CA 1.526 20 residues pruned to eliminate duplicates Z: 14 32.019 2.258 1.022 0.884 0.923 0.846 CA 1.523 13 residues pruned to eliminate duplicates Z: 19 59.827 2.798 1.068 0.943 0.944 0.667 CA 1.788 19 residues pruned to eliminate duplicates Z: 24 49.146 2.822 0.747 0.911 1.000 0.913 CA 1.473 24 residues pruned to eliminate duplicates Z: 20 57.547 2.587 0.978 0.936 1.000 0.895 CA 1.796 19 residues pruned to eliminate duplicates Z: 7 8.980 2.575 0.456 0.520 0.833 0.500 CB 1.150 7 residues pruned to eliminate duplicates Z: 27 76.145 2.682 1.341 0.867 0.923 0.615 CA 1.885 27 residues pruned to eliminate duplicates Z: 21 31.842 2.368 0.489 0.899 0.950 0.900 CA 1.519 21 residues pruned to eliminate duplicates Z: 20 57.742 2.547 1.314 0.893 0.947 0.632 CA 1.703 20 residues pruned to eliminate duplicates Z: 48 47.192 2.539 0.681 0.504 0.936 0.681 CB 1.716 48 residues pruned to eliminate duplicates Z: 24 53.103 2.853 0.577 0.946 1.000 0.957 CA 1.702 24 residues pruned to eliminate duplicates Z: 20 46.790 2.598 1.019 0.879 0.895 0.579 CA 1.659 20 residues pruned to eliminate duplicates Z: 21 34.654 2.649 0.360 0.886 0.950 0.900 CA 1.635 21 residues pruned to eliminate duplicates Z: 18 42.852 2.553 0.595 0.890 1.000 0.824 CA 1.836 19 residues pruned to eliminate duplicates Z: 27 66.878 2.627 1.147 0.868 0.923 0.731 CA 1.841 27 residues pruned to eliminate duplicates Z: 21 61.671 2.670 1.063 0.898 1.000 0.650 CA 1.791 21 residues pruned to eliminate duplicates Z: 16 22.695 1.969 0.699 0.728 0.867 0.733 CB 1.647 Z: 47 48.038 2.543 0.650 0.536 0.978 0.587 CB 1.666 47 residues pruned to eliminate duplicates Z: 9 32.598 2.449 1.233 0.694 1.000 0.625 CA 1.765 9 residues pruned to eliminate duplicates Z: 20 57.519 2.629 1.033 0.904 0.947 0.842 CA 1.857 20 residues pruned to eliminate duplicates Z: 28 44.209 2.696 0.771 0.790 0.852 0.556 CA 1.621 28 residues pruned to eliminate duplicates Z: 25 63.905 2.721 0.963 0.878 0.917 0.833 CA 1.932 25 residues pruned to eliminate duplicates Z: 28 54.585 2.491 0.946 0.851 0.926 0.556 CA 1.732 28 residues pruned to eliminate duplicates Z: 26 48.159 2.716 0.493 0.905 1.000 0.880 CA 1.691 26 residues pruned to eliminate duplicates Z: 24 69.665 2.746 1.092 0.895 1.000 0.870 CA 1.812 24 residues pruned to eliminate duplicates Z: 18 61.187 2.731 1.471 0.859 0.882 0.765 CA 1.835 18 residues pruned to eliminate duplicates Z: 25 61.535 2.550 1.080 0.873 1.000 0.667 CA 1.725 25 residues pruned to eliminate duplicates Z: 20 41.754 2.471 0.738 0.882 1.000 0.842 CA 1.615 20 residues pruned to eliminate duplicates Z: 18 58.734 2.603 1.272 0.879 0.941 0.647 CA 1.856 18 residues pruned to eliminate duplicates Z: 19 76.467 2.767 1.533 0.944 0.944 0.667 CA 1.885 18 residues pruned to eliminate duplicates Z: 13 42.751 2.359 1.170 0.890 1.000 0.500 CA 1.734 14 residues pruned to eliminate duplicates Z: 20 71.170 2.611 1.338 0.929 0.947 0.526 CA 1.976 20 residues pruned to eliminate duplicates Z: 21 76.720 2.615 1.557 0.913 1.000 0.600 CA 1.815 21 residues pruned to eliminate duplicates Z: 26 77.642 2.714 1.473 0.878 0.960 0.560 CA 1.748 26 residues pruned to eliminate duplicates Z: 25 74.990 2.789 1.164 0.897 0.917 0.833 CA 1.980 25 residues pruned to eliminate duplicates Z: 8 22.506 2.456 0.994 0.784 0.714 0.429 CA 1.894 Z: 19 47.146 2.806 0.928 0.852 0.889 0.389 CB 1.710 19 residues pruned to eliminate duplicates Z: 26 60.877 2.644 1.191 0.865 0.920 0.720 CA 1.674 26 residues pruned to eliminate duplicates Z: 20 66.562 2.823 1.033 0.945 1.000 0.842 CA 1.841 20 residues pruned to eliminate duplicates Z: 29 69.339 2.846 1.278 0.696 0.929 0.607 CA 1.821 29 residues pruned to eliminate duplicates Z: 6 4.925 1.999 0.469 0.671 0.600 0.600 CA 1.067 6 residues pruned to eliminate duplicates Z: 19 38.893 2.574 0.394 0.913 1.000 0.944 CA 1.809 20 residues pruned to eliminate duplicates Z: 21 70.650 2.581 1.273 0.908 1.000 0.650 CA 1.913 20 residues pruned to eliminate duplicates Z: 10 30.233 2.220 0.993 0.847 1.000 0.778 C 1.691 10 residues pruned to eliminate duplicates Z: 20 46.285 2.506 1.109 0.895 0.947 0.842 CA 1.521 Z: 8 22.499 2.424 0.820 0.734 1.000 0.571 CB 1.562 8 residues pruned to eliminate duplicates Z: 27 56.560 2.592 0.916 0.876 0.923 0.615 CA 1.758 27 residues pruned to eliminate duplicates Z: 82 50.220 2.348 0.585 0.468 0.926 0.605 CB 1.673 82 residues pruned to eliminate duplicates Z: 26 54.009 2.607 0.787 0.922 0.960 0.840 CA 1.699 26 residues pruned to eliminate duplicates Z: 21 53.406 2.527 1.091 0.892 0.950 0.700 CA 1.709 21 residues pruned to eliminate duplicates Z: 19 49.399 2.608 0.747 0.913 1.000 0.944 CA 1.808 17 residues pruned to eliminate duplicates Z: 9 24.559 2.405 1.047 0.684 0.875 0.625 CA 1.702 9 residues pruned to eliminate duplicates Z: 23 91.956 2.926 1.345 0.961 0.955 0.545 CA 2.049 24 residues pruned to eliminate duplicates Z: 13 26.030 2.185 0.636 0.911 1.000 0.917 CB 1.490 Z: 24 70.706 2.773 1.135 0.922 0.957 0.609 CA 1.831 24 residues pruned to eliminate duplicates Z: 19 60.375 2.662 1.267 0.915 0.944 0.722 CA 1.764 19 residues pruned to eliminate duplicates Z: 103 57.951 2.443 0.631 0.445 0.941 0.569 CB 1.621 48 residues pruned to eliminate duplicates Z: 25 44.005 2.607 0.761 0.930 0.958 0.833 CA 1.428 25 residues pruned to eliminate duplicates Z: 23 61.455 2.831 1.005 0.946 1.000 0.955 CA 1.597 22 residues pruned to eliminate duplicates Z: 24 55.039 2.617 1.227 0.861 0.826 0.652 CB 1.751 24 residues pruned to eliminate duplicates Z: 25 68.384 2.582 1.370 0.890 0.958 0.500 CA 1.713 25 residues pruned to eliminate duplicates Z: 27 43.676 2.586 0.406 0.891 0.962 0.885 CA 1.761 27 residues pruned to eliminate duplicates Z: 22 82.872 2.933 1.494 0.926 0.905 0.571 CA 1.916 22 residues pruned to eliminate duplicates Z: 72 44.084 2.364 0.586 0.473 0.944 0.606 CB 1.520 Z: 20 74.458 2.663 1.260 0.910 1.000 0.737 CA 2.012 21 residues pruned to eliminate duplicates Z: 15 33.332 2.751 0.432 0.898 1.000 0.929 CA 1.618 15 residues pruned to eliminate duplicates Z: 9 31.376 2.475 1.192 0.893 0.875 0.750 CA 1.677 8 residues pruned to eliminate duplicates Z: 9 16.698 2.463 0.735 0.701 0.875 0.500 CA 1.316 9 residues pruned to eliminate duplicates Z: 6 11.171 1.884 0.745 0.683 1.000 0.800 CA 1.284 5 residues pruned to eliminate duplicates Z: 20 43.128 2.600 0.928 0.899 0.842 0.526 CA 1.676 19 residues pruned to eliminate duplicates Z: 21 53.659 2.535 1.172 0.892 0.950 0.750 CA 1.647 20 residues pruned to eliminate duplicates Z: 9 25.712 2.402 1.159 0.818 0.875 0.625 CA 1.520 9 residues pruned to eliminate duplicates Z: 26 61.828 2.578 1.166 0.859 0.960 0.760 CA 1.697 25 residues pruned to eliminate duplicates Z: 20 64.885 2.733 1.208 0.892 0.947 0.474 CA 1.870 19 residues pruned to eliminate duplicates Z: 28 26.350 2.481 0.653 0.383 0.852 0.444 CB 1.644 Z: 19 70.092 2.751 1.494 0.915 0.944 0.722 CA 1.802 19 residues pruned to eliminate duplicates Z: 24 60.691 2.694 0.945 0.902 0.957 0.652 CA 1.801 24 residues pruned to eliminate duplicates Z: 9 27.582 2.353 1.143 0.814 0.875 0.625 CA 1.683 9 residues pruned to eliminate duplicates Z: 27 40.115 2.598 0.404 0.911 0.923 0.769 CA 1.657 27 residues pruned to eliminate duplicates Z: 23 72.842 2.787 1.259 0.930 1.000 0.818 CA 1.725 23 residues pruned to eliminate duplicates Z: 24 91.182 2.858 1.267 0.927 1.000 0.565 CB 2.056 23 residues pruned to eliminate duplicates Z: 11 29.732 2.346 1.020 0.832 1.000 0.900 CA 1.490 Z: 10 21.650 2.143 0.950 0.770 0.889 0.667 CB 1.530 10 residues pruned to eliminate duplicates Z: 8 15.698 2.338 0.517 0.790 0.857 0.857 CA 1.512 8 residues pruned to eliminate duplicates Z: 26 84.181 2.542 1.621 0.895 1.000 0.760 CB 1.811 26 residues pruned to eliminate duplicates Z: 12 24.238 2.365 0.568 0.929 0.909 0.818 CA 1.517 11 residues pruned to eliminate duplicates Z: 39 44.207 2.557 0.662 0.439 0.974 0.553 CB 1.847 39 residues pruned to eliminate duplicates Z: 25 63.324 2.784 0.784 0.918 1.000 0.875 CA 1.836 25 residues pruned to eliminate duplicates Z: 25 48.178 2.794 0.900 0.886 0.917 0.833 CA 1.458 25 residues pruned to eliminate duplicates Z: 8 19.533 2.505 0.929 0.578 0.857 0.857 CB 1.653 Z: 37 39.193 2.313 0.722 0.549 0.889 0.722 CB 1.758 37 residues pruned to eliminate duplicates Z: 20 43.125 2.470 0.714 0.896 1.000 0.895 CA 1.675 20 residues pruned to eliminate duplicates Z: 28 33.339 2.598 0.903 0.445 0.815 0.556 CB 1.684 41 residues pruned to eliminate duplicates Z: 26 51.490 2.639 0.741 0.907 0.960 0.800 CA 1.660 26 residues pruned to eliminate duplicates Z: 27 61.952 2.630 0.941 0.899 0.962 0.692 CA 1.769 27 residues pruned to eliminate duplicates Z: 29 72.163 2.606 1.472 0.819 0.857 0.464 CB 1.873 29 residues pruned to eliminate duplicates Z: 19 78.587 2.644 1.676 0.921 0.944 0.556 CA 1.951 18 residues pruned to eliminate duplicates Z: 9 35.001 2.651 0.880 0.840 1.000 0.875 CA 1.853 10 residues pruned to eliminate duplicates Z: 9 34.580 2.633 1.337 0.757 0.875 0.625 CB 1.806 9 residues pruned to eliminate duplicates Z: 27 50.998 2.529 0.742 0.894 0.962 0.808 CA 1.694 26 residues pruned to eliminate duplicates Z: 9 8.175 2.152 0.430 0.811 0.875 0.625 CB 0.818 Z: 10 33.621 2.354 1.263 0.805 0.889 0.667 CA 1.814 10 residues pruned to eliminate duplicates Z: 18 38.588 2.456 0.758 0.877 0.882 0.529 CA 1.784 Z: 26 56.416 2.728 0.908 0.896 0.960 0.840 CA 1.618 26 residues pruned to eliminate duplicates Z: 9 29.946 2.460 0.906 0.908 1.000 0.625 CA 1.604 9 residues pruned to eliminate duplicates Z: 20 52.708 2.603 1.050 0.920 0.947 0.842 CA 1.684 21 residues pruned to eliminate duplicates Z: 13 27.726 2.232 0.682 0.872 0.917 0.750 CB 1.696 13 residues pruned to eliminate duplicates Z: 75 54.328 2.580 0.614 0.480 0.932 0.635 CB 1.659 41 residues pruned to eliminate duplicates Z: 13 17.670 1.966 0.711 0.765 0.917 0.750 CB 1.308 Z: 11 17.003 2.271 0.468 0.854 0.900 0.900 CA 1.323 11 residues pruned to eliminate duplicates Z: 47 82.138 2.731 1.163 0.693 0.935 0.522 CA 1.838 47 residues pruned to eliminate duplicates Z: 20 66.067 2.670 1.277 0.905 0.947 0.526 CA 1.873 20 residues pruned to eliminate duplicates Z: 26 39.427 2.547 0.675 0.886 0.960 0.840 CA 1.389 26 residues pruned to eliminate duplicates Z: 8 19.630 2.406 0.406 0.839 1.000 0.571 CA 1.639 8 residues pruned to eliminate duplicates Z: 20 47.466 2.258 1.137 0.924 1.000 0.895 CB 1.585 Z: 21 34.982 2.548 1.034 0.586 0.850 0.550 CB 1.634 11 residues pruned to eliminate duplicates Z: 24 70.345 2.875 1.065 0.886 0.913 0.609 CA 1.952 24 residues pruned to eliminate duplicates Z: 20 60.751 2.532 1.183 0.893 0.947 0.474 CA 1.911 20 residues pruned to eliminate duplicates Z: 213 136.694 2.590 0.896 0.566 0.948 0.670 CB 1.890 163 residues pruned to eliminate duplicates Z: 12 39.820 2.285 1.186 0.905 1.000 0.818 CA 1.711 12 residues pruned to eliminate duplicates Z: 27 55.866 2.536 0.850 0.887 1.000 0.808 CA 1.683 27 residues pruned to eliminate duplicates Z: 6 4.148 2.114 0.850 0.498 0.600 0.600 CB 0.792 Z: 25 65.563 2.695 0.970 0.904 1.000 0.708 CA 1.796 25 residues pruned to eliminate duplicates Z: 26 57.600 2.580 0.918 0.846 1.000 0.840 CA 1.729 26 residues pruned to eliminate duplicates Z: 7 12.465 2.310 0.401 0.829 0.833 0.333 CA 1.420 7 residues pruned to eliminate duplicates Z: 27 50.698 2.659 0.732 0.863 0.923 0.846 CA 1.715 27 residues pruned to eliminate duplicates Z: 16 48.152 2.659 0.815 0.928 0.933 0.800 CA 1.932 17 residues pruned to eliminate duplicates Z: 19 57.214 2.868 1.222 0.861 0.833 0.722 CA 1.866 19 residues pruned to eliminate duplicates Z: 20 79.778 2.616 1.401 0.934 1.000 0.789 CA 2.032 20 residues pruned to eliminate duplicates Z: 19 58.191 2.832 1.081 0.918 0.944 0.833 CA 1.737 19 residues pruned to eliminate duplicates Z: 26 49.323 2.644 0.676 0.900 0.960 0.840 CA 1.657 26 residues pruned to eliminate duplicates Z: 25 80.226 2.737 1.225 0.907 0.958 0.625 CB 1.994 25 residues pruned to eliminate duplicates Z: 6 11.061 2.695 0.199 0.778 1.000 1.000 CA 1.197 6 residues pruned to eliminate duplicates Z: 49 95.568 2.768 1.358 0.712 0.938 0.458 CA 1.860 49 residues pruned to eliminate duplicates Z: 20 40.752 2.425 0.687 0.886 1.000 0.842 CA 1.649 Z: 112 101.653 2.629 0.893 0.614 0.910 0.586 CB 1.912 112 residues pruned to eliminate duplicates Z: 26 75.631 2.653 1.295 0.890 0.960 0.640 CB 1.862 26 residues pruned to eliminate duplicates Z: 19 61.387 2.706 1.290 0.843 0.944 0.611 CA 1.841 19 residues pruned to eliminate duplicates Z: 10 21.864 2.184 0.892 0.744 1.000 0.778 CB 1.418 10 residues pruned to eliminate duplicates Z: 27 57.722 2.641 0.895 0.892 0.962 0.769 CA 1.691 27 residues pruned to eliminate duplicates Z: 16 44.533 2.945 0.491 0.938 1.000 1.000 CA 1.820 16 residues pruned to eliminate duplicates Z: 20 43.153 2.365 0.913 0.863 0.947 0.789 CA 1.694 18 residues pruned to eliminate duplicates Z: 20 69.790 2.750 1.113 0.931 1.000 0.684 CA 1.926 20 residues pruned to eliminate duplicates Z: 19 36.765 2.409 0.570 0.886 1.000 0.889 CA 1.652 19 residues pruned to eliminate duplicates Z: 19 56.346 2.618 1.224 0.824 1.000 0.556 CA 1.723 19 residues pruned to eliminate duplicates Z: 20 37.685 2.474 0.605 0.880 1.000 0.842 CA 1.577 20 residues pruned to eliminate duplicates Z: 19 48.939 2.492 0.920 0.916 0.944 0.722 CB 1.803 Z: 20 37.832 2.550 0.896 0.896 0.947 0.789 CA 1.358 20 residues pruned to eliminate duplicates Z: 8 14.406 2.298 0.286 0.725 0.857 0.429 CB 1.755 8 residues pruned to eliminate duplicates Z: 20 75.719 2.605 1.344 0.934 1.000 0.579 CA 1.984 20 residues pruned to eliminate duplicates Z: 10 24.812 2.300 0.867 0.828 0.889 0.667 CA 1.632 10 residues pruned to eliminate duplicates Z: 20 42.375 2.430 0.764 0.888 0.947 0.632 CA 1.724 20 residues pruned to eliminate duplicates Z: 6 5.254 2.097 1.114 0.480 0.600 0.600 N 0.902 Z: 21 70.118 2.725 1.258 0.895 1.000 0.600 CA 1.827 21 residues pruned to eliminate duplicates Z: 26 49.126 2.701 0.887 0.872 0.920 0.880 CA 1.528 26 residues pruned to eliminate duplicates Z: 15 70.230 2.972 1.510 0.940 0.929 0.643 CA 1.881 15 residues pruned to eliminate duplicates Z: 17 47.573 2.610 0.681 0.899 1.000 0.750 CA 1.938 18 residues pruned to eliminate duplicates Z: 9 14.607 2.273 0.420 0.724 0.875 0.750 N 1.494 9 residues pruned to eliminate duplicates Z: 9 27.031 2.647 1.048 0.709 0.875 0.625 CA 1.666 Z: 20 49.132 2.295 1.131 0.918 0.947 0.632 CB 1.716 20 residues pruned to eliminate duplicates Z: 12 26.830 2.359 0.664 0.879 0.909 0.727 CB 1.644 12 residues pruned to eliminate duplicates Z: 8 20.406 2.597 0.655 0.739 1.000 0.714 CB 1.449 8 residues pruned to eliminate duplicates Z: 8 12.063 2.259 0.877 0.401 0.714 0.571 N 1.671 Z: 65 56.836 2.385 0.668 0.667 0.953 0.656 CB 1.606 20 residues pruned to eliminate duplicates Z: 19 42.172 2.642 0.705 0.902 1.000 0.889 CA 1.574 19 residues pruned to eliminate duplicates Z: 20 46.183 2.503 0.710 0.859 1.000 0.842 CA 1.821 20 residues pruned to eliminate duplicates Z: 10 23.372 2.338 0.820 0.886 0.778 0.556 CA 1.700 10 residues pruned to eliminate duplicates Z: 21 33.189 2.189 0.835 0.924 1.000 0.750 CB 1.297 21 residues pruned to eliminate duplicates Z: 9 36.465 2.580 0.853 0.883 1.000 0.625 CA 1.950 9 residues pruned to eliminate duplicates Z: 8 21.139 2.482 0.829 0.713 0.857 0.714 N 1.692 8 residues pruned to eliminate duplicates Z: 6 11.417 2.138 0.583 0.777 1.000 0.600 CA 1.181 6 residues pruned to eliminate duplicates Z: 19 69.486 2.841 1.365 0.856 0.944 0.500 CA 1.903 19 residues pruned to eliminate duplicates Z: 112 100.300 2.667 0.949 0.603 0.892 0.577 CA 1.862 112 residues pruned to eliminate duplicates Z: 20 52.697 2.693 0.799 0.903 1.000 0.789 CA 1.778 20 residues pruned to eliminate duplicates Z: 131 112.758 2.636 0.950 0.613 0.923 0.615 CA 1.872 131 residues pruned to eliminate duplicates Z: 15 15.797 2.229 0.471 0.542 0.786 0.571 CB 1.572 Z: 19 67.151 2.774 1.319 0.874 0.889 0.667 CA 2.015 19 residues pruned to eliminate duplicates Z: 26 42.947 2.497 0.791 0.885 0.960 0.840 CA 1.444 26 residues pruned to eliminate duplicates Z: 9 29.333 2.386 1.618 0.734 0.750 0.500 CB 1.793 9 residues pruned to eliminate duplicates Z: 20 38.197 2.430 0.677 0.888 0.947 0.789 CA 1.635 19 residues pruned to eliminate duplicates Z: 20 47.121 2.449 0.887 0.882 1.000 0.789 CA 1.693 20 residues pruned to eliminate duplicates Z: 13 25.110 2.223 0.368 0.888 1.000 0.833 CB 1.717 13 residues pruned to eliminate duplicates Z: 25 34.824 2.598 0.485 0.927 1.000 0.917 CA 1.291 25 residues pruned to eliminate duplicates Z: 76 95.254 2.816 1.054 0.616 0.880 0.627 CA 1.938 76 residues pruned to eliminate duplicates Z: 20 43.301 2.444 0.765 0.846 1.000 0.789 CB 1.711 20 residues pruned to eliminate duplicates Z: 9 33.764 2.438 1.398 0.800 0.875 0.375 CB 1.795 9 residues pruned to eliminate duplicates Z: 20 44.882 2.383 1.072 0.877 0.947 0.789 CA 1.598 20 residues pruned to eliminate duplicates Z: 19 56.480 2.680 1.387 0.908 0.833 0.667 CA 1.773 19 residues pruned to eliminate duplicates Z: 21 33.063 2.311 0.830 0.888 1.000 0.750 CA 1.259 22 residues pruned to eliminate duplicates Z: 27 51.541 2.516 0.959 0.879 0.885 0.731 CA 1.680 27 residues pruned to eliminate duplicates Z: 21 58.321 2.620 0.919 0.941 1.000 0.700 CA 1.800 21 residues pruned to eliminate duplicates Z: 17 45.007 2.787 0.791 0.939 0.938 0.750 CA 1.671 17 residues pruned to eliminate duplicates Z: 19 35.361 2.489 0.585 0.834 0.944 0.833 CA 1.677 19 residues pruned to eliminate duplicates Z: 28 56.250 2.558 1.122 0.834 0.889 0.519 CA 1.683 28 residues pruned to eliminate duplicates Z: 19 31.229 2.214 0.516 0.877 0.944 0.833 CB 1.686 Z: 11 33.452 2.390 0.854 0.859 1.000 0.500 CA 1.757 12 residues pruned to eliminate duplicates Z: 44 23.414 2.152 0.648 0.417 0.814 0.535 CB 1.348 Z: 10 16.572 2.177 0.614 0.800 0.889 0.667 CA 1.361 8 residues pruned to eliminate duplicates Z: 20 54.237 2.560 1.311 0.879 0.947 0.474 CA 1.610 20 residues pruned to eliminate duplicates Z: 12 26.904 2.379 0.481 0.859 0.909 0.727 CB 1.863 12 residues pruned to eliminate duplicates Z: 13 15.070 2.225 0.676 0.311 0.833 0.500 CB 1.727 Z: 10 12.809 1.999 0.777 0.662 0.778 0.667 N 1.329 10 residues pruned to eliminate duplicates Z: 62 54.985 2.466 0.718 0.485 0.951 0.639 CB 1.774 17 residues pruned to eliminate duplicates Z: 23 51.557 2.777 0.944 0.864 0.864 0.682 CA 1.729 23 residues pruned to eliminate duplicates Z: 19 52.239 2.733 0.703 0.920 1.000 0.667 CA 1.863 19 residues pruned to eliminate duplicates Z: 25 22.363 2.220 0.731 0.405 1.000 0.625 CB 1.313 Z: 7 5.726 1.807 0.108 0.664 0.833 0.500 CA 1.204 7 residues pruned to eliminate duplicates Z: 13 28.111 2.231 0.688 0.876 1.000 0.750 CB 1.567 13 residues pruned to eliminate duplicates Z: 19 49.078 2.453 0.784 0.893 1.000 0.667 CA 1.898 19 residues pruned to eliminate duplicates Z: 9 15.636 2.134 0.619 0.730 0.875 0.375 N 1.487 9 residues pruned to eliminate duplicates Z: 18 67.655 2.737 1.506 0.888 0.882 0.412 CA 1.953 18 residues pruned to eliminate duplicates Z: 86 80.728 2.554 0.823 0.597 0.906 0.682 CB 1.893 86 residues pruned to eliminate duplicates Z: 13 27.333 2.314 0.855 0.886 0.917 0.750 CA 1.447 13 residues pruned to eliminate duplicates Z: 10 20.841 2.097 1.375 0.847 0.778 0.778 CB 1.331 10 residues pruned to eliminate duplicates Z: 94 73.139 2.478 0.857 0.581 0.925 0.624 CB 1.649 83 residues pruned to eliminate duplicates Z: 74 85.445 2.691 1.011 0.601 0.890 0.575 CB 1.885 74 residues pruned to eliminate duplicates Z: 21 42.056 2.210 1.111 0.894 0.900 0.600 CB 1.607 21 residues pruned to eliminate duplicates Z: 19 51.351 2.736 0.739 0.941 1.000 1.000 CA 1.766 19 residues pruned to eliminate duplicates Z: 38 21.317 2.163 0.489 0.336 0.865 0.541 CB 1.505 38 residues pruned to eliminate duplicates Z: 53 60.531 2.551 1.065 0.565 0.827 0.558 CB 1.808 64 residues pruned to eliminate duplicates Z: 20 56.275 2.574 1.318 0.915 1.000 0.684 CA 1.529 19 residues pruned to eliminate duplicates Z: 13 35.173 2.854 0.559 0.929 1.000 1.000 CA 1.597 13 residues pruned to eliminate duplicates Z: 66 49.565 2.598 0.625 0.535 0.877 0.585 CB 1.604 66 residues pruned to eliminate duplicates Z: 47 79.683 2.707 1.139 0.710 0.935 0.565 CB 1.795 36 residues pruned to eliminate duplicates Z: 19 41.750 2.285 0.754 0.923 1.000 0.889 CB 1.725 Z: 8 25.475 2.578 0.910 0.837 0.714 0.571 CB 2.048 8 residues pruned to eliminate duplicates Z: 6 9.988 2.532 0.465 0.497 0.800 0.800 CB 1.510 Z: 19 51.338 2.641 0.789 0.913 1.000 0.833 CA 1.813 19 residues pruned to eliminate duplicates Z: 14 36.188 2.696 0.791 0.830 0.923 0.846 CA 1.693 14 residues pruned to eliminate duplicates Z: 77 58.243 2.581 0.674 0.479 0.947 0.632 CB 1.667 75 residues pruned to eliminate duplicates Z: 95 75.621 2.644 0.716 0.548 0.904 0.681 CB 1.814 98 residues pruned to eliminate duplicates Z: 20 40.124 2.403 0.664 0.890 1.000 0.684 CA 1.656 20 residues pruned to eliminate duplicates Z: 20 51.047 2.530 1.108 0.907 0.947 0.684 CA 1.648 20 residues pruned to eliminate duplicates Z: 20 41.428 2.536 1.307 0.703 0.842 0.579 CB 1.603 20 residues pruned to eliminate duplicates Z: 14 21.570 2.236 0.574 0.850 0.846 0.538 CB 1.488 12 residues pruned to eliminate duplicates Z: 20 38.104 2.382 0.569 0.866 1.000 0.684 CA 1.712 20 residues pruned to eliminate duplicates Z: 19 55.266 2.647 1.204 0.874 0.944 0.833 CA 1.720 19 residues pruned to eliminate duplicates Z: 20 67.768 2.484 1.413 0.912 0.947 0.632 CB 1.939 20 residues pruned to eliminate duplicates Z: 21 33.471 2.148 0.520 0.915 1.000 0.950 CB 1.620 21 residues pruned to eliminate duplicates Z: 25 56.783 2.580 0.975 0.848 0.917 0.667 CA 1.841 25 residues pruned to eliminate duplicates Z: 9 30.830 2.591 1.225 0.793 0.875 0.750 CA 1.671 9 residues pruned to eliminate duplicates Z: 20 32.303 2.379 0.378 0.912 1.000 0.947 CA 1.600 20 residues pruned to eliminate duplicates Z: 19 43.101 2.472 0.794 0.858 1.000 0.722 CA 1.687 19 residues pruned to eliminate duplicates Z: 7 15.435 2.440 0.454 0.810 1.000 1.000 CA 1.356 7 residues pruned to eliminate duplicates Z: 22 14.796 2.250 0.665 0.242 0.762 0.429 CB 1.523 Z: 22 33.719 1.994 0.922 0.897 0.952 0.810 CB 1.443 Z: 50 46.557 2.443 0.692 0.424 0.959 0.592 CB 1.815 50 residues pruned to eliminate duplicates Z: 57 77.741 2.660 1.217 0.667 0.893 0.625 CB 1.691 48 residues pruned to eliminate duplicates Z: 41 28.756 2.336 0.568 0.386 0.900 0.425 CB 1.558 41 residues pruned to eliminate duplicates Z: 9 10.906 1.907 0.409 0.672 0.875 0.750 N 1.400 9 residues pruned to eliminate duplicates Z: 10 15.855 2.158 0.347 0.804 0.889 0.667 CA 1.569 10 residues pruned to eliminate duplicates Z: 52 31.942 2.344 0.669 0.298 0.843 0.471 CB 1.699 52 residues pruned to eliminate duplicates Z: 10 21.399 2.227 0.796 0.882 0.889 0.667 CA 1.452 Z: 11 33.036 2.378 0.835 0.864 1.000 0.500 CA 1.755 11 residues pruned to eliminate duplicates Z: 14 16.196 2.597 0.384 0.510 0.846 0.615 CB 1.463 14 residues pruned to eliminate duplicates Z: 20 37.488 2.502 0.619 0.908 1.000 0.895 CA 1.507 20 residues pruned to eliminate duplicates Z: 12 20.916 2.189 0.223 0.875 1.000 0.818 CB 1.712 12 residues pruned to eliminate duplicates Z: 21 56.922 2.434 1.260 0.935 1.000 0.500 CA 1.613 19 residues pruned to eliminate duplicates Z: 8 7.547 2.182 0.635 0.431 0.857 0.571 CB 1.002 8 residues pruned to eliminate duplicates Z: 10 41.378 2.696 1.461 0.656 1.000 0.556 CB 1.799 10 residues pruned to eliminate duplicates Z: 15 11.110 2.101 0.365 0.382 0.857 0.429 CA 1.370 15 residues pruned to eliminate duplicates Z: 13 21.669 2.212 0.643 0.856 0.833 0.583 CB 1.523 13 residues pruned to eliminate duplicates Z: 12 25.497 2.461 0.429 0.903 1.000 0.727 CB 1.558 13 residues pruned to eliminate duplicates Z: 19 55.770 2.639 0.930 0.923 0.944 0.556 CA 1.919 19 residues pruned to eliminate duplicates Z: 26 22.397 2.214 0.664 0.418 0.960 0.680 CB 1.380 13 residues pruned to eliminate duplicates Z: 10 26.127 2.182 0.708 0.892 1.000 0.667 CB 1.679 11 residues pruned to eliminate duplicates Z: 20 37.118 2.184 0.579 0.936 1.000 1.000 CB 1.719 20 residues pruned to eliminate duplicates Z: 24 54.174 2.883 0.870 0.919 1.000 0.913 CA 1.477 24 residues pruned to eliminate duplicates Z: 8 23.253 2.418 0.991 0.847 1.000 0.714 CA 1.355 8 residues pruned to eliminate duplicates Z: 22 38.093 2.218 0.897 0.890 0.905 0.667 CB 1.571 Z: 10 19.632 2.342 0.685 0.662 0.778 0.111 CA 1.835 10 residues pruned to eliminate duplicates Z: 16 24.339 2.154 0.798 0.772 0.867 0.667 CA 1.472 16 residues pruned to eliminate duplicates Z: 6 14.019 1.853 1.344 0.721 1.000 1.000 CA 1.182 6 residues pruned to eliminate duplicates Z: 24 82.750 2.770 1.410 0.911 0.913 0.565 CA 2.005 24 residues pruned to eliminate duplicates Z: 19 49.591 2.634 0.731 0.911 0.944 0.611 CA 1.924 19 residues pruned to eliminate duplicates Z: 6 9.026 1.770 1.221 0.490 1.000 0.600 CB 1.037 Z: 23 42.442 2.429 0.750 0.760 0.955 0.818 CA 1.770 21 residues pruned to eliminate duplicates Z: 68 70.646 2.569 0.813 0.607 0.940 0.657 CA 1.779 82 residues pruned to eliminate duplicates Z: 26 44.126 2.738 0.766 0.828 0.880 0.560 CA 1.562 26 residues pruned to eliminate duplicates Z: 55 40.403 2.472 0.750 0.448 0.815 0.519 CB 1.647 55 residues pruned to eliminate duplicates Z: 6 9.018 2.037 0.390 0.724 0.800 0.400 CA 1.455 Z: 12 18.932 2.317 0.327 0.857 0.909 0.636 CA 1.505 12 residues pruned to eliminate duplicates Z: 21 31.727 2.247 0.615 0.799 0.950 0.650 CA 1.584 21 residues pruned to eliminate duplicates Z: 13 28.894 2.125 0.591 0.913 1.000 0.833 CA 1.746 13 residues pruned to eliminate duplicates Z: 6 8.873 1.928 0.762 0.537 0.800 0.600 CA 1.408 6 residues pruned to eliminate duplicates Z: 74 59.837 2.616 0.714 0.496 0.918 0.712 CB 1.708 74 residues pruned to eliminate duplicates Z: 90 79.069 2.491 0.917 0.602 0.944 0.652 CB 1.687 63 residues pruned to eliminate duplicates Z: 51 44.006 2.478 0.745 0.451 0.920 0.500 CB 1.646 51 residues pruned to eliminate duplicates Z: 18 50.299 2.723 1.076 0.901 0.941 0.588 CA 1.636 18 residues pruned to eliminate duplicates Z: 24 35.232 2.593 0.707 0.614 0.826 0.522 CA 1.804 24 residues pruned to eliminate duplicates Z: 19 42.703 2.462 0.710 0.866 0.944 0.667 CA 1.854 19 residues pruned to eliminate duplicates Z: 13 28.237 2.139 0.520 0.915 1.000 0.917 CA 1.772 13 residues pruned to eliminate duplicates Z: 20 45.022 2.536 0.754 0.885 0.947 0.421 CA 1.770 20 residues pruned to eliminate duplicates Z: 12 18.751 1.873 0.741 0.797 0.909 0.818 CA 1.471 12 residues pruned to eliminate duplicates Z: 17 40.461 2.466 0.679 0.887 1.000 0.938 CB 1.761 17 residues pruned to eliminate duplicates Z: 14 22.166 2.025 0.530 0.847 0.923 0.615 CA 1.597 14 residues pruned to eliminate duplicates Z: 11 37.696 2.237 1.563 0.829 0.900 0.700 CB 1.739 11 residues pruned to eliminate duplicates Z: 27 64.083 2.478 1.289 0.881 1.000 0.538 CA 1.605 27 residues pruned to eliminate duplicates Z: 10 19.871 2.067 0.710 0.753 1.000 0.333 CA 1.497 10 residues pruned to eliminate duplicates Z: 11 24.159 1.999 0.837 0.885 1.000 0.900 CA 1.502 Z: 30 69.916 2.577 1.256 0.793 0.966 0.552 CB 1.789 30 residues pruned to eliminate duplicates Z: 19 61.692 2.708 1.248 0.923 0.944 0.667 CA 1.777 19 residues pruned to eliminate duplicates Z: 20 40.529 2.183 0.755 0.930 1.000 0.842 CB 1.697 20 residues pruned to eliminate duplicates Z: 20 36.820 2.452 0.538 0.880 1.000 0.842 CA 1.623 20 residues pruned to eliminate duplicates Z: 20 40.237 2.467 0.730 0.867 1.000 0.789 CA 1.583 20 residues pruned to eliminate duplicates Z: 19 60.614 2.693 1.221 0.925 1.000 0.722 CA 1.677 19 residues pruned to eliminate duplicates Z: 9 15.763 2.540 0.442 0.589 0.875 0.625 CA 1.597 9 residues pruned to eliminate duplicates Z: 7 5.884 1.785 0.507 0.699 0.833 0.667 CB 0.894 7 residues pruned to eliminate duplicates Z: 25 46.676 2.561 0.854 0.843 1.000 0.750 CA 1.494 25 residues pruned to eliminate duplicates Z: 12 14.730 2.013 0.221 0.887 1.000 0.909 CA 1.303 12 residues pruned to eliminate duplicates Z: 13 24.737 2.324 0.365 0.852 1.000 0.750 CB 1.665 13 residues pruned to eliminate duplicates Z: 6 8.066 1.723 0.666 0.794 1.000 0.400 N 0.971 6 residues pruned to eliminate duplicates Z: 30 73.529 2.614 1.359 0.789 0.966 0.448 CB 1.780 30 residues pruned to eliminate duplicates Z: 43 86.899 2.698 1.350 0.671 0.952 0.357 CB 1.895 41 residues pruned to eliminate duplicates Z: 87 95.803 2.624 0.996 0.637 0.930 0.674 CB 1.865 73 residues pruned to eliminate duplicates Z: 10 15.575 1.948 0.826 0.743 0.889 0.556 CB 1.321 10 residues pruned to eliminate duplicates Z: 22 43.564 2.211 1.028 0.904 0.952 0.762 CB 1.585 22 residues pruned to eliminate duplicates Z: 12 28.105 2.209 0.527 0.854 1.000 0.727 CA 1.855 12 residues pruned to eliminate duplicates Z: 29 40.355 2.758 0.663 0.510 0.929 0.571 CB 1.773 29 residues pruned to eliminate duplicates Z: 7 9.836 1.757 0.503 0.714 1.000 0.500 CA 1.252 Z: 19 40.440 2.407 0.632 0.854 1.000 0.667 CB 1.793 21 residues pruned to eliminate duplicates Z: 44 57.284 2.629 0.863 0.698 0.860 0.651 CB 1.730 64 residues pruned to eliminate duplicates Z: 20 37.728 2.431 0.571 0.890 1.000 0.947 CA 1.631 20 residues pruned to eliminate duplicates Z: 20 42.982 2.496 0.743 0.910 1.000 0.895 CA 1.607 20 residues pruned to eliminate duplicates Z: 20 33.979 2.385 0.448 0.901 0.947 0.842 CA 1.701 20 residues pruned to eliminate duplicates Z: 24 21.334 2.311 0.488 0.401 0.870 0.652 CB 1.651 Z: 22 44.045 2.192 1.013 0.893 0.952 0.667 CB 1.642 22 residues pruned to eliminate duplicates Z: 102 60.300 2.407 0.723 0.435 0.911 0.614 CB 1.700 103 residues pruned to eliminate duplicates Z: 24 89.538 2.907 1.539 0.918 0.957 0.696 CA 1.865 24 residues pruned to eliminate duplicates Z: 8 14.848 1.854 0.727 0.841 0.857 0.714 CA 1.525 8 residues pruned to eliminate duplicates Z: 35 41.931 2.535 0.589 0.693 0.912 0.824 CB 1.642 25 residues pruned to eliminate duplicates Z: 8 21.279 2.432 0.889 0.794 1.000 0.571 CA 1.353 8 residues pruned to eliminate duplicates Z: 9 28.329 2.415 0.960 0.854 1.000 0.875 CB 1.563 9 residues pruned to eliminate duplicates Z: 25 88.759 2.761 1.433 0.905 0.958 0.542 CA 2.003 27 residues pruned to eliminate duplicates Z: 24 68.411 2.735 1.286 0.934 0.913 0.565 CA 1.743 24 residues pruned to eliminate duplicates Z: 24 19.307 2.252 0.566 0.372 0.870 0.565 CB 1.506 24 residues pruned to eliminate duplicates Z: 9 16.787 2.262 0.603 0.801 1.000 0.625 CA 1.258 9 residues pruned to eliminate duplicates Z: 22 37.045 2.154 0.635 0.903 1.000 0.857 CA 1.636 22 residues pruned to eliminate duplicates Z: 24 59.658 2.880 0.982 0.903 0.957 0.739 CA 1.624 24 residues pruned to eliminate duplicates Z: 70 48.647 2.411 0.660 0.446 0.884 0.667 CB 1.750 70 residues pruned to eliminate duplicates Z: 22 40.617 2.175 0.852 0.864 0.952 0.810 CB 1.693 22 residues pruned to eliminate duplicates Z: 8 17.992 2.372 0.676 0.725 1.000 0.429 CA 1.396 8 residues pruned to eliminate duplicates Z: 27 64.034 2.658 1.119 0.825 1.000 0.538 CA 1.683 27 residues pruned to eliminate duplicates Z: 46 53.173 2.613 0.842 0.473 0.956 0.689 CB 1.771 46 residues pruned to eliminate duplicates Z: 24 86.340 2.733 1.308 0.933 1.000 0.391 CA 1.991 24 residues pruned to eliminate duplicates Z: 8 10.494 2.260 0.674 0.790 0.714 0.429 CB 1.138 8 residues pruned to eliminate duplicates Z: 20 43.801 2.425 0.875 0.862 1.000 0.895 CA 1.623 20 residues pruned to eliminate duplicates Z: 12 26.785 2.356 0.851 0.886 0.909 0.727 CA 1.470 11 residues pruned to eliminate duplicates Z: 9 13.083 2.166 0.377 0.737 0.875 0.500 CB 1.433 Z: 22 40.495 2.241 1.040 0.900 0.952 0.714 CB 1.450 22 residues pruned to eliminate duplicates Z: 66 63.376 2.495 1.044 0.640 0.846 0.492 CB 1.598 99 residues pruned to eliminate duplicates Z: 20 44.972 2.390 0.890 0.891 1.000 0.684 CA 1.643 20 residues pruned to eliminate duplicates Z: 20 38.404 2.627 1.021 0.672 0.895 0.737 CA 1.582 19 residues pruned to eliminate duplicates Z: 13 27.693 2.298 0.896 0.869 0.917 0.833 CA 1.462 13 residues pruned to eliminate duplicates Z: 17 56.438 2.723 1.198 0.881 1.000 0.875 CA 1.707 17 residues pruned to eliminate duplicates Z: 9 13.206 2.008 0.543 0.638 0.875 0.250 CA 1.512 9 residues pruned to eliminate duplicates Z: 61 29.330 2.150 0.580 0.414 0.867 0.517 CB 1.407 44 residues pruned to eliminate duplicates Z: 8 17.129 2.376 0.807 0.724 0.857 0.429 N 1.437 8 residues pruned to eliminate duplicates Z: 11 25.802 2.159 0.498 0.893 1.000 0.800 CB 1.811 11 residues pruned to eliminate duplicates Z: 33 38.049 2.602 0.767 0.453 0.906 0.625 CB 1.693 33 residues pruned to eliminate duplicates Z: 50 29.006 2.366 0.543 0.330 0.857 0.551 CB 1.596 50 residues pruned to eliminate duplicates Z: 24 76.640 2.714 1.478 0.864 0.957 0.609 CA 1.821 24 residues pruned to eliminate duplicates Z: 20 46.560 2.182 1.214 0.940 1.000 0.789 CB 1.536 19 residues pruned to eliminate duplicates Z: 17 39.487 2.520 0.600 0.888 1.000 0.812 CB 1.764 17 residues pruned to eliminate duplicates Z: 7 11.529 2.040 0.717 0.775 0.833 0.833 CA 1.265 7 residues pruned to eliminate duplicates Z: 20 39.290 2.463 0.558 0.876 1.000 0.789 CA 1.707 20 residues pruned to eliminate duplicates Z: 10 21.493 2.162 1.143 0.786 0.778 0.556 CB 1.546 10 residues pruned to eliminate duplicates Z: 19 28.032 2.031 0.621 0.870 1.000 0.667 CB 1.465 Z: 19 46.815 2.507 0.746 0.896 1.000 0.944 CA 1.806 19 residues pruned to eliminate duplicates Z: 11 35.689 2.343 1.110 0.846 1.000 0.600 CB 1.695 11 residues pruned to eliminate duplicates Z: 19 70.697 2.664 1.352 0.899 0.944 0.444 CA 2.013 19 residues pruned to eliminate duplicates Z: 10 22.363 2.263 1.038 0.799 0.889 0.444 CA 1.400 10 residues pruned to eliminate duplicates Z: 62 47.452 2.573 0.560 0.467 0.918 0.574 CB 1.705 62 residues pruned to eliminate duplicates Z: 25 78.329 2.772 1.096 0.921 1.000 0.500 CA 1.935 25 residues pruned to eliminate duplicates Z: 21 37.488 2.242 0.624 0.893 1.000 0.800 CB 1.652 21 residues pruned to eliminate duplicates Z: 20 48.799 2.735 1.004 0.853 0.895 0.632 CA 1.687 20 residues pruned to eliminate duplicates Z: 25 86.632 2.835 1.501 0.892 1.000 0.708 CA 1.791 25 residues pruned to eliminate duplicates Z: 21 32.717 2.107 0.615 0.915 0.950 0.850 CB 1.600 21 residues pruned to eliminate duplicates Z: 20 42.124 2.485 0.702 0.904 0.895 0.632 CA 1.819 20 residues pruned to eliminate duplicates Z: 24 77.083 2.695 1.556 0.868 0.870 0.217 CB 1.962 24 residues pruned to eliminate duplicates Z: 19 57.179 2.646 1.170 0.902 0.944 0.667 CA 1.773 21 residues pruned to eliminate duplicates Z: 19 36.313 2.467 0.730 0.862 0.889 0.722 CB 1.656 19 residues pruned to eliminate duplicates Z: 20 40.837 2.447 0.668 0.886 1.000 0.895 CA 1.656 20 residues pruned to eliminate duplicates Z: 26 61.798 2.743 1.087 0.853 0.920 0.600 CA 1.735 27 residues pruned to eliminate duplicates Z: 19 42.890 2.457 0.637 0.914 1.000 0.944 CA 1.778 19 residues pruned to eliminate duplicates Z: 9 24.164 2.354 0.991 0.840 1.000 0.750 CA 1.360 9 residues pruned to eliminate duplicates Z: 8 24.540 2.598 1.020 0.808 0.857 0.571 CB 1.576 8 residues pruned to eliminate duplicates Z: 47 47.758 2.501 0.675 0.551 0.935 0.543 CB 1.711 47 residues pruned to eliminate duplicates Z: 10 23.301 2.234 0.612 0.886 1.000 0.778 CB 1.557 10 residues pruned to eliminate duplicates Z: 104 37.151 2.120 0.660 0.375 0.883 0.563 CB 1.345 83 residues pruned to eliminate duplicates Z: 19 60.575 2.650 1.322 0.900 1.000 0.722 CA 1.656 19 residues pruned to eliminate duplicates Z: 31 24.128 2.411 0.590 0.365 0.900 0.500 CB 1.477 31 residues pruned to eliminate duplicates Z: 10 21.661 1.966 0.924 0.880 1.000 0.778 N 1.383 9 residues pruned to eliminate duplicates Z: 25 73.590 2.589 1.489 0.854 0.917 0.375 CA 1.879 25 residues pruned to eliminate duplicates Z: 10 22.448 2.118 0.662 0.836 0.889 0.778 CB 1.791 10 residues pruned to eliminate duplicates Z: 19 29.083 2.024 0.674 0.854 1.000 0.778 CB 1.494 19 residues pruned to eliminate duplicates Z: 13 28.105 2.285 0.925 0.830 0.833 0.583 CB 1.664 13 residues pruned to eliminate duplicates Z: 21 41.363 2.400 1.192 0.869 0.850 0.550 CA 1.511 21 residues pruned to eliminate duplicates Z: 19 45.079 2.482 0.703 0.892 1.000 0.944 CA 1.806 19 residues pruned to eliminate duplicates Z: 19 61.663 2.715 1.136 0.920 1.000 0.611 CA 1.766 19 residues pruned to eliminate duplicates Z: 53 36.870 2.354 0.652 0.412 0.885 0.538 CB 1.630 53 residues pruned to eliminate duplicates Z: 13 30.495 2.201 0.655 0.884 1.000 0.750 CB 1.746 13 residues pruned to eliminate duplicates Z: 6 8.471 1.686 0.776 0.689 1.000 0.800 N 1.064 6 residues pruned to eliminate duplicates Z: 21 29.629 2.239 0.388 0.910 1.000 0.750 CB 1.512 21 residues pruned to eliminate duplicates Z: 10 28.850 2.301 1.541 0.757 0.889 0.667 CA 1.472 10 residues pruned to eliminate duplicates Z: 12 7.321 2.161 0.615 0.309 0.636 0.455 CB 1.228 Z: 20 49.870 2.418 0.851 0.896 1.000 0.684 CB 1.831 20 residues pruned to eliminate duplicates Z: 6 8.760 2.451 0.202 0.445 1.000 0.200 CB 1.407 6 residues pruned to eliminate duplicates Z: 47 48.594 2.546 0.689 0.497 0.935 0.609 CB 1.787 47 residues pruned to eliminate duplicates Z: 18 37.121 2.682 0.650 0.923 0.941 0.765 CA 1.519 18 residues pruned to eliminate duplicates Z: 13 21.414 2.107 0.405 0.819 1.000 0.750 CA 1.583 13 residues pruned to eliminate duplicates Z: 22 31.776 2.077 0.923 0.901 0.952 0.857 CB 1.301 22 residues pruned to eliminate duplicates Z: 20 42.930 2.311 0.861 0.892 0.947 0.947 CB 1.736 20 residues pruned to eliminate duplicates Z: 20 39.107 2.250 0.695 0.885 1.000 0.789 CB 1.699 20 residues pruned to eliminate duplicates Z: 9 33.569 2.700 0.809 0.880 0.875 0.625 CB 2.011 9 residues pruned to eliminate duplicates Z: 19 45.188 2.452 0.997 0.909 0.889 0.722 CB 1.737 19 residues pruned to eliminate duplicates Z: 20 41.525 2.408 0.834 0.924 0.947 0.842 CA 1.599 20 residues pruned to eliminate duplicates Z: 8 21.589 2.227 0.568 0.861 1.000 0.714 CB 1.717 8 residues pruned to eliminate duplicates Z: 12 13.193 2.261 0.865 0.326 0.909 0.636 CB 1.256 12 residues pruned to eliminate duplicates Z: 99 92.894 2.602 1.107 0.583 0.878 0.551 CB 1.802 75 residues pruned to eliminate duplicates Z: 13 38.087 2.598 0.770 0.867 1.000 0.917 CA 1.749 13 residues pruned to eliminate duplicates Z: 18 28.289 2.270 0.294 0.890 0.941 0.824 CB 1.786 18 residues pruned to eliminate duplicates Z: 21 66.096 2.702 1.213 0.911 1.000 0.650 CA 1.751 21 residues pruned to eliminate duplicates Z: 8 12.295 1.866 0.323 0.824 1.000 1.000 CA 1.422 8 residues pruned to eliminate duplicates Z: 19 48.967 2.438 0.910 0.912 0.944 0.778 CA 1.858 19 residues pruned to eliminate duplicates Z: 19 45.315 2.491 0.726 0.898 1.000 0.833 CA 1.777 19 residues pruned to eliminate duplicates Z: 38 33.585 2.443 0.579 0.418 0.892 0.541 CB 1.748 Z: 22 53.468 2.692 1.346 0.789 0.810 0.667 CA 1.770 22 residues pruned to eliminate duplicates Z: 9 16.995 2.069 0.959 0.776 0.875 0.750 CB 1.328 9 residues pruned to eliminate duplicates Z: 32 85.357 2.814 1.245 0.783 0.968 0.613 CB 1.955 32 residues pruned to eliminate duplicates Z: 19 35.381 2.432 0.467 0.861 1.000 0.778 CA 1.718 19 residues pruned to eliminate duplicates Z: 32 32.288 2.274 0.736 0.511 0.871 0.548 CB 1.668 32 residues pruned to eliminate duplicates Z: 39 40.220 2.475 0.474 0.611 0.895 0.632 CA 1.799 39 residues pruned to eliminate duplicates Z: 97 100.437 2.617 1.152 0.631 0.875 0.500 CB 1.839 196 residues pruned to eliminate duplicates Z: 9 6.251 1.971 0.469 0.630 1.000 0.750 CB 0.676 Z: 25 77.211 2.583 1.440 0.909 0.958 0.417 CA 1.852 25 residues pruned to eliminate duplicates Z: 76 50.042 2.485 0.649 0.467 0.880 0.587 CB 1.657 76 residues pruned to eliminate duplicates Z: 39 49.733 2.565 0.960 0.453 0.868 0.474 CB 1.938 Z: 7 5.746 1.797 0.097 0.823 0.833 0.667 CB 1.079 7 residues pruned to eliminate duplicates Z: 9 14.840 2.143 0.820 0.738 1.000 0.625 CA 1.086 9 residues pruned to eliminate duplicates Z: 12 19.347 2.078 0.763 0.841 0.818 0.545 CB 1.451 11 residues pruned to eliminate duplicates Z: 19 34.951 2.450 0.437 0.895 1.000 0.833 CA 1.677 19 residues pruned to eliminate duplicates Z: 87 68.641 2.532 0.753 0.580 0.849 0.628 CB 1.819 87 residues pruned to eliminate duplicates Z: 20 26.692 2.178 0.353 0.847 0.947 0.789 CA 1.628 19 residues pruned to eliminate duplicates Z: 21 47.178 2.396 1.103 0.924 1.000 0.700 CA 1.471 21 residues pruned to eliminate duplicates Z: 46 25.099 2.144 0.714 0.476 0.822 0.644 CB 1.269 43 residues pruned to eliminate duplicates Z: 22 40.551 2.229 0.766 0.897 1.000 0.810 CB 1.609 22 residues pruned to eliminate duplicates Z: 13 25.211 2.168 0.633 0.860 0.917 0.583 CA 1.648 13 residues pruned to eliminate duplicates Z: 20 34.532 2.350 0.549 0.895 1.000 0.789 CA 1.561 20 residues pruned to eliminate duplicates Z: 139 91.463 2.473 0.943 0.586 0.891 0.594 CB 1.674 173 residues pruned to eliminate duplicates Z: 20 33.102 2.228 0.757 0.888 0.895 0.842 CA 1.562 20 residues pruned to eliminate duplicates Z: 19 67.271 2.702 1.323 0.931 1.000 0.722 CA 1.766 19 residues pruned to eliminate duplicates Z: 82 96.007 2.783 1.031 0.623 0.877 0.617 CB 1.918 82 residues pruned to eliminate duplicates Z: 20 44.952 2.401 0.847 0.857 1.000 0.684 CA 1.713 20 residues pruned to eliminate duplicates Z: 45 43.752 2.541 0.599 0.479 0.955 0.636 CB 1.737 45 residues pruned to eliminate duplicates Z: 18 49.212 2.619 1.144 0.883 0.824 0.529 CA 1.867 18 residues pruned to eliminate duplicates Z: 6 6.235 2.216 0.288 0.360 0.800 0.400 CB 1.421 Z: 19 43.012 2.478 0.814 0.881 0.944 0.778 CA 1.729 Z: 8 28.469 2.495 0.721 0.871 1.000 0.571 CA 1.828 8 residues pruned to eliminate duplicates Z: 40 34.103 2.419 0.491 0.467 0.949 0.615 CB 1.650 78 residues pruned to eliminate duplicates Z: 20 32.832 2.251 0.918 0.896 0.947 0.632 CB 1.320 20 residues pruned to eliminate duplicates Z: 22 35.125 2.013 0.961 0.912 1.000 0.762 CB 1.375 22 residues pruned to eliminate duplicates Z: 31 29.385 2.419 0.733 0.483 0.833 0.500 CB 1.562 31 residues pruned to eliminate duplicates Z: 18 7.982 1.941 0.612 0.187 0.765 0.353 CB 1.178 5 residues pruned to eliminate duplicates Z: 27 61.157 2.639 0.978 0.851 0.923 0.538 CA 1.841 27 residues pruned to eliminate duplicates Z: 25 19.112 2.270 0.416 0.457 0.917 0.667 CB 1.383 23 residues pruned to eliminate duplicates Z: 14 13.034 2.179 0.765 0.308 0.846 0.462 CB 1.375 14 residues pruned to eliminate duplicates Z: 23 44.341 2.078 1.069 0.899 1.000 0.500 CB 1.572 23 residues pruned to eliminate duplicates Z: 41 38.188 2.349 0.706 0.589 0.875 0.625 CB 1.581 19 residues pruned to eliminate duplicates Z: 21 35.191 2.240 0.550 0.901 1.000 0.750 CB 1.617 21 residues pruned to eliminate duplicates Z: 74 59.062 2.512 0.726 0.476 0.932 0.575 CB 1.753 67 residues pruned to eliminate duplicates Z: 71 67.685 2.560 0.864 0.557 0.914 0.657 CB 1.754 58 residues pruned to eliminate duplicates Z: 20 58.263 2.549 1.345 0.897 1.000 0.632 CA 1.601 20 residues pruned to eliminate duplicates Z: 8 4.851 2.119 0.342 0.352 0.714 0.429 CB 1.060 8 residues pruned to eliminate duplicates Z: 12 17.919 2.240 0.480 0.875 0.909 0.818 CB 1.303 12 residues pruned to eliminate duplicates Z: 20 36.829 2.246 1.084 0.898 0.947 0.789 CB 1.364 20 residues pruned to eliminate duplicates Z: 9 24.318 2.260 0.770 0.812 0.875 0.875 CA 1.871 11 residues pruned to eliminate duplicates Z: 24 75.124 2.864 1.460 0.923 0.913 0.609 CA 1.712 24 residues pruned to eliminate duplicates Z: 12 23.726 2.064 0.658 0.877 0.909 0.909 CA 1.670 12 residues pruned to eliminate duplicates Z: 25 63.185 2.796 1.066 0.888 0.958 0.875 CA 1.679 25 residues pruned to eliminate duplicates Z: 8 14.861 2.229 0.331 0.792 1.000 0.857 CB 1.465 Z: 45 45.775 2.573 0.691 0.490 0.932 0.636 CB 1.719 45 residues pruned to eliminate duplicates Z: 21 37.622 2.428 1.040 0.857 0.900 0.900 CA 1.391 21 residues pruned to eliminate duplicates Z: 9 19.455 2.276 0.888 0.652 1.000 0.500 CA 1.390 9 residues pruned to eliminate duplicates Z: 11 30.861 2.337 0.619 0.916 1.000 1.000 CB 1.822 11 residues pruned to eliminate duplicates Z: 19 39.162 2.682 1.188 0.540 0.833 0.500 CA 1.815 19 residues pruned to eliminate duplicates Z: 11 21.754 2.164 1.068 0.793 0.900 0.600 CA 1.322 11 residues pruned to eliminate duplicates Z: 11 20.716 2.053 0.614 0.840 0.900 0.800 CB 1.640 11 residues pruned to eliminate duplicates Z: 26 41.934 2.716 0.713 0.845 1.000 0.920 CA 1.340 26 residues pruned to eliminate duplicates Z: 6 10.463 1.975 0.552 0.653 1.000 0.400 CB 1.324 6 residues pruned to eliminate duplicates Z: 38 33.863 2.311 0.648 0.544 0.892 0.649 CB 1.570 38 residues pruned to eliminate duplicates Z: 21 36.022 2.154 0.545 0.927 1.000 0.850 CB 1.696 21 residues pruned to eliminate duplicates Z: 19 39.191 2.455 0.660 0.887 0.889 0.722 CB 1.840 19 residues pruned to eliminate duplicates Z: 70 37.174 2.277 0.590 0.465 0.899 0.594 CB 1.426 70 residues pruned to eliminate duplicates Z: 25 75.752 2.755 1.323 0.884 0.917 0.500 CA 1.904 25 residues pruned to eliminate duplicates Z: 83 53.742 2.384 0.624 0.435 0.939 0.585 CB 1.746 83 residues pruned to eliminate duplicates Z: 11 20.706 2.253 0.764 0.734 0.900 0.600 CB 1.484 11 residues pruned to eliminate duplicates Z: 9 20.555 2.398 0.865 0.656 0.875 0.375 CA 1.606 9 residues pruned to eliminate duplicates Z: 114 52.956 2.308 0.544 0.470 0.929 0.628 CB 1.551 117 residues pruned to eliminate duplicates Z: 15 34.072 2.117 1.053 0.920 1.000 0.786 CB 1.475 15 residues pruned to eliminate duplicates Z: 20 35.520 2.154 0.692 0.909 1.000 0.895 CB 1.587 Z: 13 35.335 2.804 0.800 0.886 1.000 0.917 CA 1.458 13 residues pruned to eliminate duplicates Z: 21 39.868 2.508 0.907 0.853 0.950 0.800 CA 1.450 21 residues pruned to eliminate duplicates Z: 20 38.075 2.142 0.898 0.918 1.000 0.737 CB 1.515 21 residues pruned to eliminate duplicates Z: 22 15.779 2.082 0.492 0.379 0.952 0.619 CB 1.324 22 residues pruned to eliminate duplicates Z: 19 34.864 2.354 0.574 0.875 1.000 0.722 CA 1.613 19 residues pruned to eliminate duplicates Z: 20 40.186 2.455 0.725 0.907 1.000 0.789 CA 1.547 20 residues pruned to eliminate duplicates Z: 60 37.511 2.330 0.644 0.474 0.898 0.627 CB 1.457 59 residues pruned to eliminate duplicates Z: 19 18.258 2.254 0.534 0.457 0.889 0.611 CB 1.462 19 residues pruned to eliminate duplicates Z: 10 15.169 1.953 0.711 0.792 0.778 0.667 CB 1.507 10 residues pruned to eliminate duplicates Z: 20 56.887 2.582 1.347 0.901 0.947 0.632 CA 1.622 20 residues pruned to eliminate duplicates Z: 22 78.218 2.935 1.296 0.937 1.000 0.762 CA 1.763 22 residues pruned to eliminate duplicates Z: 52 40.345 2.466 0.802 0.413 0.784 0.510 CB 1.775 52 residues pruned to eliminate duplicates Z: 9 15.672 1.945 0.795 0.765 1.000 0.625 CB 1.255 9 residues pruned to eliminate duplicates Z: 17 38.849 2.289 1.066 0.878 1.000 0.750 CB 1.490 26 residues pruned to eliminate duplicates Z: 61 69.310 2.621 0.876 0.601 0.917 0.667 CB 1.803 61 residues pruned to eliminate duplicates Z: 9 19.762 2.140 1.006 0.752 0.750 0.250 CA 1.733 9 residues pruned to eliminate duplicates Z: 22 38.779 2.305 1.060 0.888 0.952 0.857 CA 1.348 22 residues pruned to eliminate duplicates Z: 9 7.141 1.788 0.739 0.393 0.750 0.625 CB 1.213 Z: 13 21.694 2.272 0.398 0.904 1.000 0.917 CB 1.404 13 residues pruned to eliminate duplicates Z: 19 20.741 2.342 0.678 0.393 0.889 0.556 CB 1.567 20 residues pruned to eliminate duplicates Z: 19 50.312 2.709 1.070 0.899 0.944 0.667 CA 1.600 19 residues pruned to eliminate duplicates Z: 59 52.403 2.481 0.887 0.528 0.862 0.603 CB 1.657 59 residues pruned to eliminate duplicates Z: 18 36.278 2.278 0.561 0.902 1.000 0.882 CB 1.765 19 residues pruned to eliminate duplicates Z: 18 57.649 2.711 0.997 0.910 0.941 0.824 CA 1.946 18 residues pruned to eliminate duplicates Z: 21 39.845 2.091 0.784 0.909 1.000 0.850 CB 1.696 20 residues pruned to eliminate duplicates Z: 7 10.178 2.099 0.430 0.366 1.000 0.500 CB 1.599 7 residues pruned to eliminate duplicates Z: 61 65.439 2.594 0.824 0.591 0.917 0.667 CB 1.785 61 residues pruned to eliminate duplicates Z: 12 24.605 2.158 0.603 0.868 1.000 0.455 N 1.568 12 residues pruned to eliminate duplicates Z: 6 16.454 2.048 0.822 0.853 1.000 0.600 CA 1.458 6 residues pruned to eliminate duplicates Z: 13 20.085 2.083 0.623 0.851 0.833 0.833 CA 1.524 13 residues pruned to eliminate duplicates Z: 13 36.988 2.442 1.325 0.884 0.833 0.500 CA 1.631 15 residues pruned to eliminate duplicates Z: 21 39.942 2.136 1.238 0.916 0.950 0.750 CB 1.389 21 residues pruned to eliminate duplicates Z: 49 48.020 2.511 0.767 0.493 0.958 0.625 CB 1.642 49 residues pruned to eliminate duplicates Z: 9 6.090 1.955 0.079 0.427 1.000 0.625 CB 1.101 Z: 12 21.465 2.300 0.779 0.841 0.818 0.545 CB 1.441 12 residues pruned to eliminate duplicates Z: 6 6.794 1.665 0.703 0.704 1.000 0.600 CA 0.890 Z: 19 40.845 2.493 0.647 0.886 0.944 0.889 CB 1.791 19 residues pruned to eliminate duplicates Z: 15 19.997 2.158 0.603 0.749 0.786 0.571 CB 1.573 15 residues pruned to eliminate duplicates Z: 14 16.338 2.166 0.488 0.512 1.000 0.692 CB 1.389 14 residues pruned to eliminate duplicates Z: 20 50.786 2.617 0.931 0.877 0.947 0.895 CA 1.767 20 residues pruned to eliminate duplicates Z: 22 49.066 2.396 1.096 0.880 1.000 0.667 CA 1.545 22 residues pruned to eliminate duplicates Z: 12 22.140 2.416 0.244 0.882 1.000 0.909 CB 1.608 12 residues pruned to eliminate duplicates Z: 14 36.280 2.201 1.148 0.893 0.923 0.769 CA 1.655 14 residues pruned to eliminate duplicates Z: 9 15.269 2.204 1.003 0.792 0.750 0.500 CB 1.262 9 residues pruned to eliminate duplicates Z: 7 9.414 1.864 0.484 0.805 0.833 0.500 CB 1.278 7 residues pruned to eliminate duplicates Z: 25 48.040 2.527 0.857 0.910 1.000 0.750 CA 1.482 25 residues pruned to eliminate duplicates Z: 54 42.103 2.380 0.622 0.427 0.925 0.604 CB 1.748 54 residues pruned to eliminate duplicates Z: 12 22.372 2.030 0.595 0.848 1.000 0.545 CB 1.545 12 residues pruned to eliminate duplicates Z: 13 30.822 2.260 0.590 0.893 1.000 0.750 CB 1.778 13 residues pruned to eliminate duplicates Z: 12 16.043 2.357 0.585 0.572 0.909 0.727 CB 1.328 12 residues pruned to eliminate duplicates Z: 18 66.729 2.653 1.572 0.890 0.941 0.529 CA 1.813 37 residues pruned to eliminate duplicates Z: 17 14.347 2.382 0.477 0.355 0.750 0.312 CB 1.590 17 residues pruned to eliminate duplicates Z: 48 47.231 2.556 0.568 0.553 0.936 0.660 CB 1.744 48 residues pruned to eliminate duplicates Z: 20 30.551 2.083 0.636 0.924 0.947 0.895 CA 1.525 20 residues pruned to eliminate duplicates Z: 56 52.204 2.497 0.613 0.589 0.927 0.782 CB 1.729 56 residues pruned to eliminate duplicates Z: 11 29.874 2.241 1.022 0.891 0.900 0.800 CA 1.666 11 residues pruned to eliminate duplicates Z: 36 14.191 2.060 0.351 0.290 0.800 0.486 CB 1.364 36 residues pruned to eliminate duplicates Z: 36 36.875 2.405 0.657 0.582 0.914 0.657 CB 1.582 36 residues pruned to eliminate duplicates Z: 29 13.282 2.122 0.440 0.165 0.857 0.464 CB 1.441 29 residues pruned to eliminate duplicates Z: 16 29.522 2.191 0.527 0.899 1.000 0.867 CA 1.629 18 residues pruned to eliminate duplicates Z: 49 56.448 2.502 0.972 0.644 0.833 0.562 CA 1.732 46 residues pruned to eliminate duplicates Z: 27 55.699 2.593 0.700 0.897 1.000 0.692 CA 1.773 27 residues pruned to eliminate duplicates Z: 18 29.469 2.257 0.337 0.909 0.941 0.882 CB 1.787 18 residues pruned to eliminate duplicates Z: 9 31.722 2.351 0.813 0.897 1.000 0.500 CB 1.884 9 residues pruned to eliminate duplicates Z: 8 22.949 2.424 0.755 0.801 1.000 0.714 CA 1.567 8 residues pruned to eliminate duplicates Z: 21 31.237 2.029 0.578 0.916 1.000 0.850 CB 1.540 21 residues pruned to eliminate duplicates Z: 81 57.833 2.436 0.803 0.455 0.913 0.562 CB 1.690 74 residues pruned to eliminate duplicates Z: 10 29.461 2.458 0.991 0.782 0.889 0.667 CB 1.761 10 residues pruned to eliminate duplicates Z: 10 12.519 2.009 0.468 0.434 1.000 0.667 CB 1.515 10 residues pruned to eliminate duplicates Z: 102 65.737 2.460 0.696 0.473 0.941 0.614 CB 1.712 102 residues pruned to eliminate duplicates Z: 10 21.216 2.071 0.657 0.852 0.889 0.778 CA 1.714 10 residues pruned to eliminate duplicates Z: 13 30.353 2.394 0.649 0.846 0.917 0.833 CB 1.799 13 residues pruned to eliminate duplicates Z: 9 6.548 2.115 0.270 0.398 1.000 0.500 CB 0.959 9 residues pruned to eliminate duplicates Z: 9 20.440 2.173 0.506 0.824 1.000 0.875 CA 1.668 9 residues pruned to eliminate duplicates Z: 19 28.772 2.180 0.303 0.895 1.000 0.944 CA 1.711 19 residues pruned to eliminate duplicates Z: 9 20.340 2.125 1.150 0.884 0.875 0.625 CB 1.300 9 residues pruned to eliminate duplicates Z: 6 9.353 1.849 0.855 0.743 1.000 0.600 CB 0.981 6 residues pruned to eliminate duplicates Z: 30 28.140 2.559 0.549 0.453 0.862 0.586 CB 1.604 30 residues pruned to eliminate duplicates Z: 70 37.324 2.315 0.580 0.444 0.884 0.594 CB 1.473 70 residues pruned to eliminate duplicates Z: 70 53.853 2.594 0.617 0.522 0.928 0.609 CB 1.630 70 residues pruned to eliminate duplicates Z: 35 49.250 2.618 0.917 0.703 0.853 0.706 CA 1.639 28 residues pruned to eliminate duplicates Z: 164 104.517 2.594 0.824 0.571 0.920 0.601 CB 1.755 258 residues pruned to eliminate duplicates Z: 19 38.387 2.459 0.497 0.890 1.000 0.944 CA 1.768 19 residues pruned to eliminate duplicates Z: 19 32.818 2.463 0.341 0.872 1.000 0.778 CA 1.706 19 residues pruned to eliminate duplicates Z: 21 43.282 2.200 1.050 0.916 1.000 0.850 CB 1.516 21 residues pruned to eliminate duplicates Z: 21 32.928 2.079 0.606 0.880 1.000 0.700 CA 1.598 21 residues pruned to eliminate duplicates Z: 21 48.443 2.312 1.076 0.892 1.000 0.750 CB 1.621 22 residues pruned to eliminate duplicates Z: 74 58.383 2.381 0.715 0.585 0.932 0.603 CB 1.657 74 residues pruned to eliminate duplicates Z: 35 37.581 2.438 0.513 0.623 0.912 0.647 CB 1.705 35 residues pruned to eliminate duplicates Z: 99 39.526 2.221 0.528 0.403 0.888 0.561 CB 1.468 104 residues pruned to eliminate duplicates Z: 11 17.646 2.274 0.813 0.421 0.900 0.700 CB 1.632 Z: 19 41.896 2.460 0.682 0.917 0.944 0.667 CA 1.783 19 residues pruned to eliminate duplicates Z: 21 40.188 2.203 1.012 0.854 0.950 0.800 CA 1.577 21 residues pruned to eliminate duplicates Z: 51 51.289 2.530 0.603 0.587 0.940 0.660 CB 1.750 51 residues pruned to eliminate duplicates Z: 20 35.294 2.227 0.725 0.888 1.000 0.842 CB 1.518 20 residues pruned to eliminate duplicates Z: 22 42.709 2.126 1.109 0.910 0.952 0.762 CB 1.548 22 residues pruned to eliminate duplicates Z: 8 10.898 1.955 0.222 0.717 0.857 0.571 CA 1.652 8 residues pruned to eliminate duplicates Z: 22 46.384 2.176 1.307 0.934 0.952 0.714 CB 1.477 22 residues pruned to eliminate duplicates Z: 167 98.576 2.485 0.906 0.603 0.892 0.602 CB 1.643 258 residues pruned to eliminate duplicates Z: 19 34.610 2.323 0.780 0.854 0.833 0.556 CA 1.748 19 residues pruned to eliminate duplicates Z: 23 38.196 2.043 1.045 0.833 0.955 0.773 CA 1.532 23 residues pruned to eliminate duplicates Z: 12 10.125 1.988 0.621 0.390 0.909 0.545 CB 1.172 Z: 7 34.418 2.838 1.255 0.779 0.833 0.833 CA 2.059 7 residues pruned to eliminate duplicates Z: 17 4.663 1.663 0.624 0.213 0.562 0.500 CB 1.076 17 residues pruned to eliminate duplicates Z: 64 43.242 2.234 0.664 0.601 0.921 0.635 CB 1.445 Z: 12 26.013 2.298 0.833 0.839 0.818 0.727 CA 1.699 12 residues pruned to eliminate duplicates Z: 62 40.050 2.248 0.620 0.577 0.869 0.639 CB 1.505 61 residues pruned to eliminate duplicates Z: 9 21.554 2.314 0.995 0.847 0.750 0.625 CB 1.634 9 residues pruned to eliminate duplicates Z: 76 55.118 2.464 0.705 0.439 0.933 0.627 CB 1.728 76 residues pruned to eliminate duplicates Z: 12 24.489 2.219 0.983 0.829 0.909 0.818 CA 1.389 12 residues pruned to eliminate duplicates Z: 8 4.672 1.929 0.354 0.211 0.714 0.429 CA 1.331 Z: 50 42.136 2.440 0.609 0.388 0.980 0.633 CB 1.762 50 residues pruned to eliminate duplicates Z: 21 37.058 2.253 0.601 0.813 1.000 0.650 CB 1.749 21 residues pruned to eliminate duplicates Z: 20 34.126 2.466 0.467 0.869 1.000 0.895 CA 1.580 20 residues pruned to eliminate duplicates Z: 9 26.196 2.303 1.095 0.893 1.000 0.875 CA 1.378 9 residues pruned to eliminate duplicates Z: 6 21.725 2.390 0.759 0.777 1.000 0.800 CA 1.809 6 residues pruned to eliminate duplicates Z: 26 65.076 2.702 1.348 0.894 0.960 0.680 CA 1.532 26 residues pruned to eliminate duplicates Z: 20 74.379 2.785 1.434 0.925 0.947 0.526 CA 1.864 20 residues pruned to eliminate duplicates Z: 26 57.843 2.686 0.974 0.811 0.920 0.600 CA 1.809 26 residues pruned to eliminate duplicates Z: 31 25.783 2.253 0.631 0.468 0.900 0.667 CB 1.471 31 residues pruned to eliminate duplicates Z: 7 3.873 1.955 0.331 0.697 1.000 0.500 CB 0.507 Z: 10 21.860 2.211 0.659 0.903 0.889 0.778 CA 1.593 10 residues pruned to eliminate duplicates Z: 82 58.350 2.403 0.656 0.569 0.914 0.753 CB 1.668 84 residues pruned to eliminate duplicates Z: 13 24.780 2.263 0.938 0.772 0.917 0.750 CA 1.399 13 residues pruned to eliminate duplicates Z: 12 33.530 2.256 1.092 0.819 1.000 0.545 CA 1.625 12 residues pruned to eliminate duplicates Z: 11 21.099 1.982 0.607 0.863 1.000 0.800 CA 1.537 Z: 22 29.444 2.022 0.815 0.873 0.952 0.762 CB 1.339 22 residues pruned to eliminate duplicates Z: 19 43.087 2.324 0.910 0.902 1.000 0.944 CB 1.632 19 residues pruned to eliminate duplicates Z: 19 29.958 2.208 0.337 0.872 1.000 0.889 CB 1.744 19 residues pruned to eliminate duplicates Z: 27 10.256 2.154 0.448 0.252 0.692 0.462 CB 1.239 27 residues pruned to eliminate duplicates Z: 23 29.313 2.590 0.275 0.719 0.955 0.818 CA 1.626 23 residues pruned to eliminate duplicates Z: 20 43.412 2.482 0.755 0.907 0.895 0.474 CA 1.816 20 residues pruned to eliminate duplicates Z: 15 13.756 2.250 0.530 0.296 0.857 0.571 CB 1.565 15 residues pruned to eliminate duplicates Z: 19 51.122 2.292 1.201 0.918 1.000 0.611 CB 1.684 26 residues pruned to eliminate duplicates Z: 11 16.492 2.251 0.728 0.458 0.800 0.600 N 1.751 11 residues pruned to eliminate duplicates Z: 67 83.984 2.551 1.135 0.677 0.909 0.606 CB 1.774 67 residues pruned to eliminate duplicates Z: 34 30.546 2.419 0.448 0.596 0.879 0.636 CB 1.577 34 residues pruned to eliminate duplicates Z: 49 49.750 2.548 0.686 0.496 0.938 0.604 CA 1.790 49 residues pruned to eliminate duplicates Z: 57 65.720 2.552 1.218 0.683 0.804 0.429 CB 1.632 60 residues pruned to eliminate duplicates Z: 93 87.047 2.519 1.060 0.633 0.913 0.620 CB 1.690 80 residues pruned to eliminate duplicates Z: 26 76.719 2.564 1.512 0.895 0.920 0.480 CA 1.856 26 residues pruned to eliminate duplicates Z: 62 59.460 2.535 0.881 0.548 0.902 0.623 CB 1.690 62 residues pruned to eliminate duplicates Z: 9 22.983 2.388 0.861 0.827 0.875 0.875 CB 1.575 Z: 19 39.043 2.440 0.688 0.859 0.944 0.778 CB 1.741 19 residues pruned to eliminate duplicates Z: 61 47.724 2.502 0.651 0.472 0.900 0.683 CB 1.705 Z: 13 21.934 2.291 0.421 0.837 0.917 0.667 CA 1.587 13 residues pruned to eliminate duplicates Z: 104 73.420 2.456 0.903 0.552 0.913 0.583 CB 1.612 93 residues pruned to eliminate duplicates Z: 93 79.191 2.533 0.764 0.636 0.880 0.674 CB 1.848 93 residues pruned to eliminate duplicates Z: 19 48.889 2.292 1.173 0.943 1.000 0.944 CB 1.604 19 residues pruned to eliminate duplicates Z: 71 58.339 2.415 0.852 0.574 0.871 0.629 CA 1.666 71 residues pruned to eliminate duplicates Z: 52 45.474 2.322 0.680 0.529 0.941 0.608 CB 1.686 52 residues pruned to eliminate duplicates Z: 8 5.539 1.911 0.570 0.451 0.571 0.429 CB 1.284 Z: 8 20.900 2.336 0.585 0.802 1.000 0.714 CB 1.638 8 residues pruned to eliminate duplicates Z: 104 66.375 2.427 0.714 0.530 0.913 0.660 CB 1.673 104 residues pruned to eliminate duplicates Z: 19 52.907 2.473 0.888 0.905 1.000 0.778 CB 1.901 19 residues pruned to eliminate duplicates Z: 11 5.135 1.670 0.633 0.216 0.800 0.600 CA 1.040 13 residues pruned to eliminate duplicates Z: 10 12.131 1.939 0.500 0.737 0.889 0.556 CB 1.265 10 residues pruned to eliminate duplicates Z: 13 21.840 2.038 0.671 0.794 0.917 0.750 CB 1.561 13 residues pruned to eliminate duplicates Z: 9 5.041 1.975 -0.131 0.803 1.000 0.750 CB 0.797 Z: 30 31.638 2.406 0.925 0.516 0.862 0.448 CB 1.449 7 residues pruned to eliminate duplicates Z: 11 22.673 2.349 1.170 0.594 0.900 0.400 CB 1.429 11 residues pruned to eliminate duplicates Z: 66 36.493 2.227 0.472 0.418 0.938 0.569 CB 1.601 66 residues pruned to eliminate duplicates Z: 12 16.518 1.793 0.493 0.885 0.909 0.909 CA 1.478 12 residues pruned to eliminate duplicates Z: 18 15.976 2.329 0.661 0.345 0.824 0.353 CB 1.440 18 residues pruned to eliminate duplicates Z: 42 39.445 2.513 0.649 0.514 0.927 0.634 CB 1.582 42 residues pruned to eliminate duplicates Z: 20 27.590 2.172 0.658 0.861 0.895 0.842 CB 1.443 20 residues pruned to eliminate duplicates Z: 13 29.058 2.328 0.628 0.873 0.917 0.667 CB 1.759 13 residues pruned to eliminate duplicates Z: 20 57.028 2.558 1.092 0.932 0.947 0.579 CA 1.803 20 residues pruned to eliminate duplicates Z: 11 22.274 2.049 0.905 0.825 0.900 0.700 N 1.514 11 residues pruned to eliminate duplicates Z: 10 10.462 2.073 0.450 0.640 0.889 0.667 CB 1.145 12 residues pruned to eliminate duplicates Z: 20 39.763 2.200 0.897 0.886 1.000 0.895 CB 1.576 20 residues pruned to eliminate duplicates Z: 9 5.591 1.524 0.842 0.763 1.000 0.750 CB 0.557 9 residues pruned to eliminate duplicates Z: 8 3.934 1.842 0.243 0.356 0.714 0.429 CB 1.061 Z: 11 23.535 2.017 0.926 0.843 1.000 0.800 CB 1.426 11 residues pruned to eliminate duplicates Z: 21 39.057 2.154 1.022 0.829 0.900 0.700 CB 1.677 21 residues pruned to eliminate duplicates Z: 18 32.644 2.268 0.465 0.869 1.000 0.824 CB 1.740 18 residues pruned to eliminate duplicates Z: 108 70.540 2.430 0.821 0.528 0.907 0.636 CB 1.654 108 residues pruned to eliminate duplicates Z: 10 32.147 2.232 1.324 0.834 0.889 0.667 CB 1.741 10 residues pruned to eliminate duplicates Z: 66 33.766 2.187 0.676 0.446 0.923 0.477 CB 1.308 66 residues pruned to eliminate duplicates Z: 38 25.518 2.201 0.529 0.479 0.892 0.568 CB 1.427 38 residues pruned to eliminate duplicates Z: 19 32.124 2.185 0.667 0.916 1.000 0.944 CB 1.468 19 residues pruned to eliminate duplicates Z: 16 7.183 1.867 0.284 0.402 0.733 0.400 CB 1.169 16 residues pruned to eliminate duplicates Z: 21 39.483 2.200 0.718 0.937 1.000 0.900 CB 1.626 21 residues pruned to eliminate duplicates Z: 13 41.886 2.349 1.424 0.921 0.917 0.667 CA 1.630 12 residues pruned to eliminate duplicates Z: 96 74.982 2.473 0.907 0.555 0.926 0.684 CB 1.669 67 residues pruned to eliminate duplicates Z: 19 48.038 2.497 0.803 0.895 1.000 0.889 CA 1.803 19 residues pruned to eliminate duplicates Z: 14 25.667 2.214 0.679 0.837 0.846 0.769 CB 1.693 14 residues pruned to eliminate duplicates Z: 44 31.351 2.243 0.554 0.513 0.953 0.605 CB 1.420 44 residues pruned to eliminate duplicates Z: 48 43.187 2.559 0.704 0.487 0.872 0.617 CB 1.677 48 residues pruned to eliminate duplicates Z: 9 16.655 2.059 0.665 0.811 1.000 0.750 CA 1.310 9 residues pruned to eliminate duplicates Z: 28 58.058 2.846 0.930 0.828 0.963 0.815 CA 1.591 28 residues pruned to eliminate duplicates Z: 14 32.615 2.219 0.772 0.857 1.000 0.769 CB 1.695 14 residues pruned to eliminate duplicates Z: 9 9.671 1.845 0.331 0.845 0.875 0.875 CB 1.184 9 residues pruned to eliminate duplicates Z: 20 50.846 2.653 1.079 0.909 0.895 0.526 CA 1.678 20 residues pruned to eliminate duplicates Z: 19 43.011 2.466 0.872 0.889 0.944 0.778 CB 1.674 19 residues pruned to eliminate duplicates Z: 19 25.744 2.193 0.332 0.837 0.889 0.556 CB 1.749 19 residues pruned to eliminate duplicates Z: 6 5.978 2.092 0.394 0.656 0.600 0.400 CB 1.321 6 residues pruned to eliminate duplicates Z: 14 15.709 2.088 0.394 0.576 0.923 0.538 CB 1.506 14 residues pruned to eliminate duplicates Z: 59 46.075 2.562 0.592 0.481 0.862 0.638 CB 1.754 59 residues pruned to eliminate duplicates Z: 12 22.751 2.279 0.435 0.917 0.909 0.727 CB 1.629 12 residues pruned to eliminate duplicates Z: 20 27.488 2.461 1.024 0.581 0.737 0.684 CA 1.590 Z: 76 52.052 2.359 0.647 0.582 0.880 0.653 CB 1.625 74 residues pruned to eliminate duplicates Z: 149 88.327 2.462 0.973 0.539 0.878 0.561 CB 1.637 174 residues pruned to eliminate duplicates Z: 12 28.593 2.280 0.637 0.867 1.000 0.727 CB 1.690 12 residues pruned to eliminate duplicates Z: 9 15.948 1.913 0.485 0.836 1.000 0.625 N 1.486 9 residues pruned to eliminate duplicates Z: 26 45.789 2.697 0.650 0.750 1.000 0.840 CA 1.647 26 residues pruned to eliminate duplicates Z: 21 26.533 1.999 0.682 0.905 0.900 0.800 CB 1.395 21 residues pruned to eliminate duplicates Z: 13 31.225 2.101 0.780 0.925 1.000 0.750 N 1.692 13 residues pruned to eliminate duplicates Z: 20 46.459 2.411 0.833 0.929 1.000 0.789 CA 1.687 20 residues pruned to eliminate duplicates Z: 85 78.749 2.518 0.939 0.601 0.905 0.571 CB 1.767 85 residues pruned to eliminate duplicates Z: 12 21.053 2.152 0.285 0.896 1.000 0.909 CB 1.645 12 residues pruned to eliminate duplicates Z: 93 90.183 2.630 0.930 0.614 0.935 0.609 CB 1.779 93 residues pruned to eliminate duplicates Z: 20 39.210 2.435 0.690 0.876 1.000 0.789 CA 1.588 20 residues pruned to eliminate duplicates Z: 20 35.115 2.226 0.705 0.919 1.000 0.895 CB 1.495 20 residues pruned to eliminate duplicates Z: 90 56.134 2.409 0.746 0.518 0.876 0.618 CB 1.586 90 residues pruned to eliminate duplicates Z: 8 6.336 1.752 0.625 0.656 1.000 0.857 CA 0.728 8 residues pruned to eliminate duplicates Z: 7 17.797 2.442 0.579 0.858 1.000 0.833 CB 1.387 7 residues pruned to eliminate duplicates Z: 100 94.960 2.563 1.014 0.622 0.899 0.596 CA 1.834 100 residues pruned to eliminate duplicates Z: 8 3.624 1.695 -0.140 0.453 0.714 0.429 CB 1.381 Z: 64 51.642 2.498 0.621 0.499 0.952 0.619 CB 1.688 64 residues pruned to eliminate duplicates Z: 20 38.996 2.430 0.703 0.853 0.947 0.842 CA 1.686 20 residues pruned to eliminate duplicates Z: 19 37.036 2.322 1.072 0.935 0.944 0.889 CB 1.338 19 residues pruned to eliminate duplicates Z: 30 30.795 2.377 0.813 0.520 0.862 0.621 CB 1.510 22 residues pruned to eliminate duplicates Z: 72 47.232 2.411 0.718 0.443 0.944 0.577 CB 1.521 72 residues pruned to eliminate duplicates Z: 6 4.637 2.012 0.529 0.296 0.600 0.600 C 1.411 Z: 17 30.324 2.392 0.478 0.923 1.000 0.938 CA 1.508 17 residues pruned to eliminate duplicates Z: 10 24.455 2.321 1.072 0.771 0.889 0.556 CA 1.500 10 residues pruned to eliminate duplicates Z: 9 15.364 2.224 0.872 0.544 0.875 0.625 CB 1.427 9 residues pruned to eliminate duplicates Z: 8 18.478 2.337 0.597 0.568 1.000 0.571 CB 1.751 8 residues pruned to eliminate duplicates Z: 21 29.879 2.324 0.278 0.852 1.000 0.900 CA 1.664 21 residues pruned to eliminate duplicates Z: 25 40.260 2.418 0.731 0.862 0.958 0.875 CA 1.503 25 residues pruned to eliminate duplicates Z: 6 7.513 1.782 1.414 0.717 0.600 0.400 N 1.070 6 residues pruned to eliminate duplicates Z: 15 13.447 2.061 0.689 0.493 0.857 0.500 CB 1.213 15 residues pruned to eliminate duplicates Z: 18 6.740 1.914 0.433 0.325 0.706 0.412 CB 1.024 Z: 116 98.613 2.629 0.941 0.593 0.904 0.609 CA 1.824 116 residues pruned to eliminate duplicates Z: 6 5.327 1.659 0.153 0.870 1.000 1.000 CA 0.909 Z: 6 10.493 2.163 0.619 0.713 0.800 0.800 CA 1.381 6 residues pruned to eliminate duplicates Z: 20 65.447 2.654 1.364 0.912 0.895 0.632 CA 1.894 Z: 21 31.774 2.182 0.762 0.890 1.000 0.750 CB 1.329 21 residues pruned to eliminate duplicates Z: 11 12.744 2.052 0.887 0.494 0.700 0.400 N 1.496 Z: 11 6.230 2.061 0.428 0.360 0.700 0.600 CB 1.111 Z: 10 11.415 1.939 0.319 0.791 0.889 0.778 CB 1.296 10 residues pruned to eliminate duplicates Z: 63 45.405 2.493 0.535 0.498 0.903 0.581 CB 1.672 63 residues pruned to eliminate duplicates Z: 16 12.057 2.150 0.281 0.295 0.867 0.600 CB 1.640 16 residues pruned to eliminate duplicates Z: 11 22.634 2.431 0.588 0.830 1.000 0.900 CB 1.394 11 residues pruned to eliminate duplicates Z: 27 79.115 2.591 1.466 0.861 0.962 0.462 CA 1.855 27 residues pruned to eliminate duplicates Z: 20 42.346 2.602 0.595 0.922 1.000 0.947 CA 1.646 20 residues pruned to eliminate duplicates Z: 77 55.973 2.500 0.686 0.478 0.908 0.539 CB 1.715 77 residues pruned to eliminate duplicates Z: 19 40.776 2.408 0.922 0.869 0.889 0.611 CA 1.706 19 residues pruned to eliminate duplicates Z: 39 30.506 2.254 0.768 0.521 0.816 0.684 CB 1.491 36 residues pruned to eliminate duplicates Z: 118 99.670 2.565 0.891 0.611 0.923 0.573 CB 1.853 118 residues pruned to eliminate duplicates Z: 13 16.687 1.999 0.452 0.684 1.000 0.833 CB 1.402 11 residues pruned to eliminate duplicates Z: 13 31.925 2.181 1.052 0.910 1.000 0.750 CA 1.461 13 residues pruned to eliminate duplicates Z: 8 12.135 2.244 0.271 0.717 0.857 0.571 CB 1.541 8 residues pruned to eliminate duplicates Z: 6 10.780 1.590 1.018 0.841 1.000 0.800 CA 1.120 Z: 13 25.655 2.259 0.970 0.855 0.917 0.750 CB 1.340 13 residues pruned to eliminate duplicates Z: 50 53.934 2.594 0.710 0.491 0.939 0.653 CA 1.866 67 residues pruned to eliminate duplicates Z: 25 20.927 2.058 0.756 0.491 0.792 0.458 CB 1.507 25 residues pruned to eliminate duplicates Z: 6 5.979 1.637 0.148 0.745 1.000 0.600 CB 1.143 Z: 72 62.575 2.584 0.723 0.576 0.887 0.549 CB 1.747 72 residues pruned to eliminate duplicates Z: 65 52.491 2.443 0.704 0.509 0.922 0.641 CB 1.694 65 residues pruned to eliminate duplicates Z: 20 45.579 2.394 0.767 0.894 1.000 0.737 CA 1.773 20 residues pruned to eliminate duplicates Z: 21 12.806 1.907 0.576 0.409 0.750 0.350 CB 1.397 21 residues pruned to eliminate duplicates 6 0.464 2.132 0.349 0.797 1.000 0.600 CB 0.056 ? Z: 8 6.561 1.678 0.904 0.401 0.857 0.286 CB 1.006 Z: 25 86.613 2.712 1.505 0.902 0.958 0.625 CA 1.937 25 residues pruned to eliminate duplicates Z: 13 18.068 2.034 1.248 0.457 0.833 0.750 CA 1.430 13 residues pruned to eliminate duplicates Z: 81 57.451 2.449 0.712 0.516 0.887 0.637 CB 1.700 26 residues pruned to eliminate duplicates Z: 20 23.249 2.139 0.149 0.899 1.000 0.842 CA 1.552 19 residues pruned to eliminate duplicates Z: 9 17.174 2.003 0.877 0.792 0.875 0.625 CB 1.429 9 residues pruned to eliminate duplicates Z: 19 48.785 2.488 0.991 0.897 1.000 0.778 CA 1.662 19 residues pruned to eliminate duplicates Z: 52 47.847 2.517 0.587 0.540 0.941 0.549 CB 1.713 52 residues pruned to eliminate duplicates Z: 7 15.989 2.466 0.647 0.762 0.833 0.500 CB 1.528 7 residues pruned to eliminate duplicates Z: 23 14.617 2.149 0.575 0.387 0.818 0.545 CB 1.269 23 residues pruned to eliminate duplicates Z: 31 40.873 2.549 0.774 0.496 0.933 0.600 CB 1.776 Z: 13 25.224 2.057 0.908 0.891 1.000 0.833 CA 1.333 13 residues pruned to eliminate duplicates Z: 20 38.958 2.185 1.086 0.927 1.000 0.789 CB 1.374 20 residues pruned to eliminate duplicates Z: 15 76.229 2.834 1.530 0.904 1.000 0.857 CA 2.023 15 residues pruned to eliminate duplicates Z: 98 72.245 2.634 0.724 0.550 0.866 0.701 CB 1.776 83 residues pruned to eliminate duplicates Z: 36 47.907 2.598 0.630 0.710 0.914 0.800 CA 1.727 36 residues pruned to eliminate duplicates Z: 7 6.184 2.141 0.322 0.359 0.667 0.500 CB 1.557 Z: 72 38.168 2.228 0.578 0.471 0.887 0.563 CB 1.496 72 residues pruned to eliminate duplicates Z: 33 24.294 2.435 0.494 0.303 0.906 0.562 CB 1.623 33 residues pruned to eliminate duplicates Z: 9 6.279 2.038 -0.221 0.450 1.000 0.500 CB 1.471 Z: 132 83.441 2.409 0.905 0.603 0.885 0.603 CB 1.626 132 residues pruned to eliminate duplicates Z: 21 32.632 2.219 0.497 0.907 1.000 0.850 CB 1.561 21 residues pruned to eliminate duplicates Z: 9 12.021 1.864 0.438 0.869 1.000 0.875 CB 1.157 9 residues pruned to eliminate duplicates Z: 35 47.988 2.510 0.911 0.698 0.912 0.647 CB 1.571 35 residues pruned to eliminate duplicates Z: 10 18.806 2.259 0.688 0.880 0.889 0.444 CA 1.340 10 residues pruned to eliminate duplicates Z: 43 48.439 2.469 0.617 0.562 1.000 0.548 CB 1.763 43 residues pruned to eliminate duplicates Z: 11 9.971 1.880 0.867 0.390 0.700 0.400 CA 1.442 11 residues pruned to eliminate duplicates Z: 21 61.501 2.785 1.320 0.931 0.800 0.500 CA 1.860 21 residues pruned to eliminate duplicates Z: 15 42.964 2.453 1.219 0.873 0.929 0.643 CA 1.655 15 residues pruned to eliminate duplicates Z: 19 45.216 2.487 0.804 0.879 1.000 0.778 CA 1.723 19 residues pruned to eliminate duplicates Z: 10 16.178 2.110 0.934 0.819 0.778 0.667 CA 1.289 10 residues pruned to eliminate duplicates Z: 12 12.540 2.012 0.567 0.380 0.909 0.273 CB 1.499 Z: 101 56.414 2.415 0.650 0.396 0.920 0.550 CB 1.716 101 residues pruned to eliminate duplicates Z: 19 37.821 2.454 0.610 0.892 1.000 0.722 CB 1.621 19 residues pruned to eliminate duplicates Z: 94 113.312 2.690 1.198 0.649 0.925 0.570 CB 1.870 94 residues pruned to eliminate duplicates Z: 64 55.842 2.511 0.747 0.512 0.937 0.651 CB 1.693 64 residues pruned to eliminate duplicates Z: 6 2.726 1.893 0.092 0.367 1.000 0.400 CB 0.680 Z: 20 32.767 2.712 0.458 0.851 0.947 0.895 CA 1.485 20 residues pruned to eliminate duplicates Z: 27 27.142 2.383 0.508 0.424 0.923 0.615 CB 1.737 27 residues pruned to eliminate duplicates Z: 84 47.682 2.469 0.642 0.432 0.855 0.614 CB 1.620 84 residues pruned to eliminate duplicates Z: 9 12.092 1.934 0.380 0.726 1.000 0.625 CB 1.306 9 residues pruned to eliminate duplicates Z: 37 25.132 2.371 0.522 0.315 0.861 0.528 CB 1.654 37 residues pruned to eliminate duplicates Z: 19 28.276 2.222 0.381 0.864 0.944 0.778 CB 1.685 19 residues pruned to eliminate duplicates Z: 58 68.428 2.521 1.094 0.632 0.877 0.632 CB 1.729 58 residues pruned to eliminate duplicates Z: 20 34.598 2.224 0.728 0.915 0.947 0.842 CB 1.540 20 residues pruned to eliminate duplicates Z: 30 59.752 2.526 1.274 0.684 0.897 0.621 CB 1.819 30 residues pruned to eliminate duplicates Z: 24 46.673 2.726 0.742 0.887 1.000 0.913 CA 1.477 24 residues pruned to eliminate duplicates Z: 8 3.371 1.781 0.643 0.071 0.714 0.286 CB 1.067 Z: 45 33.290 2.284 0.876 0.328 0.886 0.545 CB 1.596 45 residues pruned to eliminate duplicates Z: 106 66.979 2.404 0.789 0.515 0.914 0.667 CB 1.638 321 residues pruned to eliminate duplicates Z: 7 9.178 1.989 0.312 0.534 0.833 0.333 N 1.666 Z: 21 40.345 2.276 0.876 0.898 0.950 0.850 CB 1.591 21 residues pruned to eliminate duplicates Z: 7 5.656 2.061 0.846 0.311 0.833 0.667 CB 0.898 Z: 42 28.008 2.259 0.533 0.387 0.878 0.463 CB 1.621 42 residues pruned to eliminate duplicates Z: 19 27.613 2.203 0.290 0.900 0.944 0.722 CA 1.732 19 residues pruned to eliminate duplicates Z: 12 12.870 2.001 0.186 0.836 0.909 0.818 CA 1.346 Z: 8 4.986 1.848 0.363 0.263 0.714 0.286 CB 1.373 8 residues pruned to eliminate duplicates Z: 8 14.443 2.046 0.463 0.742 0.857 0.714 CA 1.713 Z: 8 4.179 2.089 -0.299 0.574 1.000 0.571 CB 1.004 8 residues pruned to eliminate duplicates Z: 62 51.654 2.383 0.681 0.668 0.885 0.689 CB 1.597 62 residues pruned to eliminate duplicates Z: 18 29.374 2.080 0.534 0.902 1.000 0.941 CB 1.593 18 residues pruned to eliminate duplicates Z: 42 39.067 2.324 0.546 0.540 0.902 0.634 CB 1.810 42 residues pruned to eliminate duplicates Z: 14 17.923 2.064 0.185 0.894 1.000 0.846 CA 1.459 14 residues pruned to eliminate duplicates Z: 24 29.729 2.360 0.606 0.476 0.957 0.652 CB 1.751 24 residues pruned to eliminate duplicates Z: 20 28.850 2.308 0.744 0.912 1.000 0.895 CA 1.164 20 residues pruned to eliminate duplicates 6 1.482 1.363 0.405 0.316 0.400 0.400 CA 1.060 ? Z: 20 49.416 2.407 1.080 0.901 1.000 0.895 CA 1.616 20 residues pruned to eliminate duplicates Z: 10 22.908 2.291 0.636 0.834 1.000 0.778 CA 1.527 10 residues pruned to eliminate duplicates Z: 16 7.064 1.779 0.738 0.218 0.667 0.400 CB 1.232 Z: 18 26.274 2.054 0.640 0.849 0.941 0.824 CB 1.489 18 residues pruned to eliminate duplicates Z: 10 29.639 2.461 1.184 0.838 0.778 0.667 CB 1.766 10 residues pruned to eliminate duplicates Z: 21 20.833 2.318 0.702 0.316 0.850 0.550 CB 1.703 21 residues pruned to eliminate duplicates Z: 10 10.934 2.265 0.596 0.288 0.778 0.556 CB 1.646 10 residues pruned to eliminate duplicates Z: 24 81.346 2.765 1.295 0.892 0.957 0.478 CA 2.007 24 residues pruned to eliminate duplicates Z: 12 17.546 2.335 0.828 0.439 1.000 0.545 CB 1.319 12 residues pruned to eliminate duplicates Z: 50 47.274 2.487 0.753 0.504 0.939 0.714 CB 1.643 57 residues pruned to eliminate duplicates Z: 7 7.450 2.091 0.980 0.554 0.667 0.667 CB 1.045 Z: 41 32.080 2.158 0.786 0.571 0.900 0.550 CB 1.365 52 residues pruned to eliminate duplicates Z: 10 11.612 2.123 0.385 0.335 1.000 0.444 CB 1.576 10 residues pruned to eliminate duplicates 6 0.392 2.017 0.447 0.295 0.400 0.400 CB 0.189 ? Z: 21 9.963 1.817 0.359 0.323 0.800 0.450 O 1.371 10 residues pruned to eliminate duplicates Z: 7 19.383 2.510 0.703 0.769 0.833 0.833 N 1.751 7 residues pruned to eliminate duplicates Z: 6 3.441 2.182 0.213 0.475 0.600 0.400 CB 0.994 6 residues pruned to eliminate duplicates Z: 19 43.912 2.410 0.923 0.907 0.944 0.778 CA 1.680 19 residues pruned to eliminate duplicates Z: 6 4.979 1.766 0.870 0.678 0.800 0.600 CB 0.715 6 residues pruned to eliminate duplicates Z: 11 17.856 1.964 0.633 0.830 0.900 0.700 CA 1.471 11 residues pruned to eliminate duplicates Z: 15 14.908 2.070 0.635 0.327 0.929 0.429 CB 1.532 15 residues pruned to eliminate duplicates Z: 7 14.454 2.362 0.642 0.679 0.833 0.500 CB 1.548 Z: 71 58.162 2.489 0.738 0.492 0.900 0.600 CB 1.800 102 residues pruned to eliminate duplicates Z: 19 29.334 2.010 1.020 0.877 0.889 0.611 CB 1.391 19 residues pruned to eliminate duplicates Z: 11 12.849 2.167 0.185 0.714 0.900 0.900 CB 1.448 11 residues pruned to eliminate duplicates Z: 55 45.624 2.439 0.841 0.465 0.907 0.556 CB 1.579 55 residues pruned to eliminate duplicates Z: 68 70.437 2.539 0.977 0.577 0.910 0.672 CB 1.748 68 residues pruned to eliminate duplicates Z: 31 23.240 2.274 0.767 0.449 0.833 0.567 CB 1.334 Z: 20 22.654 2.210 0.667 0.495 0.947 0.842 CB 1.495 20 residues pruned to eliminate duplicates Z: 10 22.579 2.237 0.649 0.819 0.889 0.778 CA 1.739 10 residues pruned to eliminate duplicates Z: 6 12.895 1.785 0.843 0.818 1.000 0.800 N 1.329 6 residues pruned to eliminate duplicates Z: 12 12.486 1.951 0.208 0.880 0.909 0.818 CB 1.274 12 residues pruned to eliminate duplicates Z: 21 32.640 2.102 0.478 0.902 1.000 0.850 CA 1.677 21 residues pruned to eliminate duplicates Z: 33 25.397 2.328 0.602 0.412 0.906 0.500 CB 1.456 33 residues pruned to eliminate duplicates Z: 98 37.045 2.238 0.522 0.363 0.876 0.515 CB 1.461 98 residues pruned to eliminate duplicates Z: 33 18.141 2.163 0.443 0.289 0.875 0.531 CB 1.488 33 residues pruned to eliminate duplicates Z: 20 28.775 2.206 0.374 0.890 1.000 0.842 CA 1.567 20 residues pruned to eliminate duplicates Z: 20 38.126 2.178 0.901 0.917 1.000 0.842 CB 1.491 20 residues pruned to eliminate duplicates Z: 14 30.244 2.092 1.067 0.820 0.923 0.692 CB 1.592 14 residues pruned to eliminate duplicates Z: 9 12.342 2.139 0.098 0.806 1.000 1.000 CB 1.423 9 residues pruned to eliminate duplicates Z: 40 26.090 2.243 0.569 0.487 0.846 0.692 CB 1.421 12 residues pruned to eliminate duplicates Z: 22 32.946 2.140 0.583 0.865 1.000 0.810 CA 1.556 22 residues pruned to eliminate duplicates Z: 49 69.693 2.576 1.093 0.703 0.917 0.438 CA 1.692 49 residues pruned to eliminate duplicates Z: 18 25.919 2.120 0.450 0.910 0.941 0.882 CA 1.541 18 residues pruned to eliminate duplicates Z: 20 54.458 2.554 1.131 0.907 0.895 0.684 CA 1.824 20 residues pruned to eliminate duplicates Z: 11 12.639 2.269 0.532 0.643 0.700 0.700 CB 1.436 7 residues pruned to eliminate duplicates Z: 19 33.441 2.044 0.911 0.860 0.944 0.833 CB 1.571 19 residues pruned to eliminate duplicates Z: 21 34.520 2.160 0.671 0.876 0.950 0.850 CA 1.636 21 residues pruned to eliminate duplicates Z: 6 4.064 1.996 -0.154 0.422 0.800 0.600 CB 1.459 Z: 10 8.131 1.829 0.667 0.443 0.778 0.556 CB 1.213 10 residues pruned to eliminate duplicates Z: 23 94.136 2.692 1.766 0.942 1.000 0.318 CA 1.870 Z: 24 65.705 2.756 1.140 0.867 0.913 0.435 CA 1.861 24 residues pruned to eliminate duplicates Z: 7 17.002 2.354 0.447 0.851 1.000 0.833 CB 1.508 7 residues pruned to eliminate duplicates Z: 13 39.721 2.441 1.048 0.879 0.917 0.833 CA 1.814 13 residues pruned to eliminate duplicates Z: 18 85.148 2.822 1.693 0.947 0.941 0.588 CA 1.996 20 residues pruned to eliminate duplicates Z: 69 55.501 2.434 0.830 0.592 0.882 0.632 CB 1.569 69 residues pruned to eliminate duplicates Z: 26 76.884 2.645 1.252 0.891 1.000 0.760 CA 1.857 26 residues pruned to eliminate duplicates Z: 20 35.568 2.081 0.831 0.897 1.000 0.789 CA 1.532 20 residues pruned to eliminate duplicates Z: 36 72.262 2.687 1.044 0.772 0.943 0.543 CA 1.855 35 residues pruned to eliminate duplicates Z: 33 18.537 2.146 0.348 0.346 0.938 0.438 CB 1.429 33 residues pruned to eliminate duplicates Z: 20 82.576 2.764 1.624 0.936 0.947 0.632 CA 1.920 Z: 47 54.596 2.642 0.819 0.489 0.935 0.674 CA 1.811 47 residues pruned to eliminate duplicates Z: 8 21.848 2.279 0.731 0.811 1.000 0.857 CB 1.597 8 residues pruned to eliminate duplicates Z: 53 32.935 2.261 0.454 0.488 0.923 0.692 CB 1.523 53 residues pruned to eliminate duplicates Z: 13 11.099 1.848 0.817 0.474 0.917 0.500 CA 1.069 13 residues pruned to eliminate duplicates Z: 57 39.839 2.247 0.787 0.532 0.857 0.589 CB 1.499 59 residues pruned to eliminate duplicates Z: 47 41.991 2.315 0.831 0.530 0.913 0.522 CB 1.553 47 residues pruned to eliminate duplicates Z: 21 30.254 2.292 0.683 0.786 0.900 0.550 CA 1.516 21 residues pruned to eliminate duplicates Z: 6 2.973 2.002 0.571 0.239 0.600 0.600 CB 0.954 6 residues pruned to eliminate duplicates Z: 64 40.047 2.162 0.666 0.566 0.889 0.667 CB 1.479 60 residues pruned to eliminate duplicates Z: 11 3.754 1.775 0.497 0.191 0.500 0.400 CB 1.292 Z: 27 57.703 2.643 1.371 0.883 0.962 0.615 CA 1.358 27 residues pruned to eliminate duplicates Z: 79 46.800 2.345 0.686 0.447 0.872 0.590 CB 1.624 79 residues pruned to eliminate duplicates Z: 15 20.211 2.015 0.756 0.769 0.857 0.571 CB 1.403 20 residues pruned to eliminate duplicates Z: 79 47.486 2.239 0.822 0.498 0.859 0.551 CB 1.537 79 residues pruned to eliminate duplicates Z: 22 39.718 2.578 0.937 0.660 0.857 0.381 CB 1.746 22 residues pruned to eliminate duplicates Z: 22 16.480 2.318 0.321 0.383 0.857 0.381 CB 1.552 22 residues pruned to eliminate duplicates Z: 9 5.744 1.578 1.122 0.214 0.750 0.375 C 1.132 Z: 70 96.593 2.720 1.271 0.601 0.928 0.406 CA 1.843 70 residues pruned to eliminate duplicates Z: 13 24.427 2.067 0.535 0.912 0.917 0.750 CB 1.717 13 residues pruned to eliminate duplicates Z: 50 41.077 2.434 0.734 0.383 0.898 0.551 CB 1.754 50 residues pruned to eliminate duplicates Z: 10 7.261 2.073 0.318 0.587 0.778 0.778 CB 1.048 Z: 21 69.003 2.679 1.321 0.933 1.000 0.600 CA 1.733 21 residues pruned to eliminate duplicates Z: 24 41.143 2.460 0.534 0.784 1.000 0.783 CA 1.771 24 residues pruned to eliminate duplicates Z: 20 26.062 2.113 0.313 0.841 1.000 0.789 CA 1.606 20 residues pruned to eliminate duplicates Z: 20 45.121 2.464 0.777 0.877 1.000 0.789 CA 1.717 20 residues pruned to eliminate duplicates Z: 9 6.184 1.661 0.595 0.369 0.875 0.500 CB 1.085 Z: 12 23.905 2.146 0.822 0.856 1.000 0.727 CB 1.359 12 residues pruned to eliminate duplicates Z: 80 38.963 2.255 0.571 0.431 0.924 0.557 CB 1.439 48 residues pruned to eliminate duplicates Z: 19 54.267 2.646 1.224 0.904 0.944 0.667 CA 1.640 19 residues pruned to eliminate duplicates Z: 19 31.596 2.032 0.805 0.873 1.000 0.833 CB 1.479 19 residues pruned to eliminate duplicates Z: 19 59.909 2.799 0.955 0.946 1.000 0.667 CA 1.785 19 residues pruned to eliminate duplicates Z: 92 44.827 2.242 0.614 0.446 0.923 0.560 CB 1.487 92 residues pruned to eliminate duplicates Z: 70 56.228 2.427 0.730 0.527 0.942 0.725 CB 1.666 52 residues pruned to eliminate duplicates Z: 76 62.871 2.498 0.821 0.530 0.893 0.693 CB 1.734 69 residues pruned to eliminate duplicates Z: 7 9.294 2.079 0.589 0.466 1.000 0.667 CB 1.189 Z: 49 48.957 2.579 0.715 0.473 0.917 0.583 CB 1.791 49 residues pruned to eliminate duplicates Z: 20 31.672 2.175 0.514 0.879 0.947 0.789 CA 1.689 20 residues pruned to eliminate duplicates Z: 10 31.851 2.512 0.970 0.840 1.000 0.778 CA 1.600 10 residues pruned to eliminate duplicates Z: 14 28.149 1.953 0.735 0.908 1.000 0.923 CB 1.637 14 residues pruned to eliminate duplicates Z: 12 13.610 1.961 0.344 0.819 0.909 0.727 CB 1.299 12 residues pruned to eliminate duplicates Z: 48 84.104 2.665 1.185 0.730 0.936 0.468 CB 1.830 56 residues pruned to eliminate duplicates Z: 17 48.575 2.562 1.356 0.897 0.875 0.438 CA 1.646 17 residues pruned to eliminate duplicates Z: 41 26.074 2.417 0.568 0.255 0.850 0.525 CB 1.695 50 residues pruned to eliminate duplicates Z: 83 60.428 2.495 0.655 0.488 0.927 0.622 CB 1.764 83 residues pruned to eliminate duplicates Z: 141 115.835 2.571 0.941 0.624 0.936 0.650 CA 1.865 141 residues pruned to eliminate duplicates Z: 6 7.375 1.920 0.363 0.753 0.800 0.800 CA 1.257 6 residues pruned to eliminate duplicates Z: 56 28.798 2.229 0.533 0.435 0.836 0.582 CB 1.453 56 residues pruned to eliminate duplicates Z: 13 23.785 2.055 0.562 0.896 1.000 0.500 CA 1.532 13 residues pruned to eliminate duplicates Z: 21 20.466 1.998 0.602 0.426 1.000 0.600 CB 1.543 21 residues pruned to eliminate duplicates Z: 25 33.521 2.279 0.528 0.718 0.958 0.667 CB 1.683 20 residues pruned to eliminate duplicates Z: 10 6.343 1.978 0.347 0.469 0.778 0.556 CB 1.054 10 residues pruned to eliminate duplicates Z: 34 29.420 2.506 0.584 0.420 0.879 0.606 CB 1.595 34 residues pruned to eliminate duplicates Z: 18 8.537 1.896 0.270 0.303 0.882 0.588 CB 1.214 18 residues pruned to eliminate duplicates Z: 30 33.955 2.559 0.700 0.473 0.897 0.724 CB 1.661 30 residues pruned to eliminate duplicates Z: 16 35.192 2.373 0.696 0.886 1.000 0.867 CB 1.629 16 residues pruned to eliminate duplicates Z: 22 29.538 2.145 0.591 0.873 1.000 0.810 CB 1.376 22 residues pruned to eliminate duplicates Z: 82 58.786 2.377 0.705 0.580 0.926 0.667 CB 1.612 200 residues pruned to eliminate duplicates Z: 74 77.270 2.641 0.865 0.589 0.918 0.685 CB 1.838 106 residues pruned to eliminate duplicates Z: 22 48.324 2.167 1.250 0.901 1.000 0.857 CA 1.543 22 residues pruned to eliminate duplicates Z: 19 65.483 2.703 1.077 0.932 1.000 0.722 CA 1.919 23 residues pruned to eliminate duplicates Z: 11 11.145 2.294 0.593 0.281 0.800 0.400 CB 1.543 11 residues pruned to eliminate duplicates Z: 20 19.635 2.295 0.509 0.335 0.947 0.526 CB 1.643 20 residues pruned to eliminate duplicates Z: 11 15.302 1.879 0.392 0.894 1.000 0.800 CA 1.327 11 residues pruned to eliminate duplicates Z: 20 41.424 2.558 0.944 0.924 0.947 0.684 CA 1.416 20 residues pruned to eliminate duplicates Z: 24 21.880 2.241 0.445 0.480 0.957 0.565 CB 1.503 24 residues pruned to eliminate duplicates Z: 79 40.641 2.267 0.618 0.451 0.846 0.513 CB 1.560 Z: 8 5.652 2.155 0.078 0.375 0.714 0.429 O 1.471 Z: 9 3.115 1.731 0.340 0.215 0.625 0.250 N 1.062 Z: 21 29.263 2.160 0.581 0.891 0.950 0.800 CB 1.450 24 residues pruned to eliminate duplicates Z: 10 22.598 2.240 0.926 0.786 0.778 0.333 CA 1.744 10 residues pruned to eliminate duplicates Z: 67 50.900 2.305 0.719 0.615 0.939 0.667 CB 1.509 67 residues pruned to eliminate duplicates Z: 20 33.495 2.090 0.995 0.844 1.000 0.632 CB 1.371 20 residues pruned to eliminate duplicates Z: 28 21.661 2.052 0.570 0.550 0.852 0.593 CB 1.447 28 residues pruned to eliminate duplicates Z: 7 7.152 1.753 0.658 0.715 0.833 0.333 N 0.992 Z: 79 61.891 2.464 0.763 0.588 0.936 0.731 CB 1.584 79 residues pruned to eliminate duplicates Z: 15 11.211 1.997 0.414 0.389 1.000 0.643 CB 1.194 Z: 8 12.271 2.211 0.339 0.744 0.857 0.857 CB 1.469 8 residues pruned to eliminate duplicates Z: 26 19.788 2.170 0.547 0.393 0.960 0.640 CB 1.375 26 residues pruned to eliminate duplicates Z: 85 75.028 2.511 1.020 0.548 0.881 0.595 CB 1.747 78 residues pruned to eliminate duplicates Z: 21 22.223 2.376 0.663 0.470 0.850 0.650 CA 1.525 Z: 20 30.244 2.364 0.580 0.858 0.947 0.789 CA 1.444 20 residues pruned to eliminate duplicates Z: 28 23.572 2.118 0.514 0.668 0.852 0.593 CB 1.421 28 residues pruned to eliminate duplicates Z: 18 24.760 2.008 0.629 0.882 0.882 0.824 CA 1.506 18 residues pruned to eliminate duplicates Z: 8 14.096 2.020 0.407 0.733 1.000 0.571 N 1.520 8 residues pruned to eliminate duplicates Z: 11 9.527 1.994 0.854 0.392 0.800 0.400 CB 1.142 11 residues pruned to eliminate duplicates Z: 19 30.277 2.012 0.692 0.879 1.000 0.722 CB 1.520 19 residues pruned to eliminate duplicates Z: 14 7.626 2.409 0.324 0.211 0.769 0.385 CB 1.213 14 residues pruned to eliminate duplicates Z: 79 37.747 2.259 0.538 0.421 0.859 0.603 CB 1.556 79 residues pruned to eliminate duplicates Z: 8 6.614 1.764 0.653 0.370 0.714 0.286 CB 1.379 Z: 9 18.455 2.024 0.997 0.668 0.875 0.625 CB 1.579 Z: 6 4.337 1.353 0.822 0.850 1.000 0.600 CA 0.583 Z: 6 6.210 1.937 0.191 0.516 0.800 0.600 CB 1.482 Z: 73 65.840 2.521 0.850 0.569 0.889 0.667 CB 1.752 73 residues pruned to eliminate duplicates Z: 75 32.130 2.241 0.472 0.463 0.865 0.622 CB 1.359 75 residues pruned to eliminate duplicates Z: 8 17.882 2.256 0.825 0.577 0.857 0.714 CA 1.777 8 residues pruned to eliminate duplicates Z: 6 2.985 1.697 0.548 0.414 0.600 0.400 O 0.927 Z: 9 18.453 2.371 0.712 0.611 0.875 0.875 CB 1.653 9 residues pruned to eliminate duplicates Z: 27 42.973 2.381 0.930 0.866 0.885 0.615 CA 1.517 27 residues pruned to eliminate duplicates Z: 24 60.809 2.706 0.913 0.915 0.913 0.609 CA 1.896 24 residues pruned to eliminate duplicates Z: 19 31.923 2.251 0.449 0.924 1.000 0.944 CB 1.619 19 residues pruned to eliminate duplicates Z: 66 95.946 2.807 1.106 0.651 0.923 0.600 CA 1.895 66 residues pruned to eliminate duplicates Z: 35 26.736 2.221 0.695 0.417 0.882 0.529 CB 1.506 35 residues pruned to eliminate duplicates Z: 45 34.917 2.417 0.574 0.434 0.955 0.682 CB 1.551 45 residues pruned to eliminate duplicates Z: 12 19.588 1.964 0.868 0.763 0.909 0.455 CB 1.401 12 residues pruned to eliminate duplicates Z: 18 47.873 2.676 1.163 0.883 0.882 0.529 CA 1.645 18 residues pruned to eliminate duplicates Z: 65 56.503 2.539 0.613 0.569 0.938 0.734 CA 1.720 85 residues pruned to eliminate duplicates Z: 6 7.586 1.697 0.944 0.637 0.800 0.600 CB 1.131 Z: 19 61.260 2.357 1.452 0.932 1.000 0.944 CA 1.745 19 residues pruned to eliminate duplicates Z: 24 66.704 2.808 1.249 0.900 1.000 0.696 CA 1.573 24 residues pruned to eliminate duplicates Z: 11 4.438 2.026 0.247 0.374 0.700 0.400 CB 0.908 Z: 16 24.399 2.531 0.710 0.533 0.867 0.600 CB 1.626 16 residues pruned to eliminate duplicates Z: 98 72.708 2.470 0.842 0.583 0.918 0.588 CB 1.633 95 residues pruned to eliminate duplicates Z: 8 11.114 2.103 0.514 0.627 1.000 0.714 CB 1.170 Z: 12 14.002 2.184 0.037 0.769 0.909 0.727 CA 1.615 12 residues pruned to eliminate duplicates Z: 26 21.730 2.173 0.675 0.418 0.960 0.680 CB 1.355 Z: 9 10.897 2.027 0.560 0.617 0.875 0.750 CB 1.247 8 residues pruned to eliminate duplicates Z: 6 4.910 1.567 0.575 0.698 1.000 0.600 N 0.743 6 residues pruned to eliminate duplicates Z: 44 28.826 2.191 0.718 0.500 0.884 0.628 CB 1.321 44 residues pruned to eliminate duplicates Z: 21 36.442 1.986 0.977 0.925 1.000 0.850 CB 1.456 25 residues pruned to eliminate duplicates Z: 7 9.564 1.477 0.906 0.771 0.833 0.500 N 1.310 7 residues pruned to eliminate duplicates Z: 68 49.482 2.418 0.607 0.482 0.940 0.597 CB 1.685 68 residues pruned to eliminate duplicates Z: 9 5.712 2.050 0.142 0.629 0.750 0.625 CB 1.018 Z: 25 25.186 2.176 0.644 0.488 0.917 0.625 CB 1.588 25 residues pruned to eliminate duplicates Z: 20 52.139 2.382 1.033 0.917 1.000 0.737 CA 1.743 20 residues pruned to eliminate duplicates Z: 11 22.139 2.166 0.625 0.883 1.000 0.700 CB 1.438 11 residues pruned to eliminate duplicates Z: 19 10.368 1.974 0.584 0.233 0.833 0.333 CB 1.280 19 residues pruned to eliminate duplicates Z: 7 27.067 2.324 1.559 0.777 1.000 0.833 CA 1.455 7 residues pruned to eliminate duplicates Z: 10 18.389 2.173 0.448 0.864 0.889 0.667 CB 1.607 10 residues pruned to eliminate duplicates Z: 18 26.276 2.288 0.516 0.869 0.824 0.706 CB 1.630 18 residues pruned to eliminate duplicates Z: 6 8.018 1.831 0.811 0.697 1.000 0.800 CA 0.903 6 residues pruned to eliminate duplicates Z: 16 30.764 2.276 0.400 0.887 1.000 0.867 CA 1.798 16 residues pruned to eliminate duplicates Z: 8 6.755 2.063 0.358 0.474 0.714 0.429 CB 1.310 8 residues pruned to eliminate duplicates Z: 8 18.819 2.287 0.871 0.829 0.857 0.714 CA 1.459 8 residues pruned to eliminate duplicates Z: 42 37.789 2.338 0.660 0.553 0.878 0.610 CB 1.644 42 residues pruned to eliminate duplicates Z: 6 7.043 1.780 0.771 0.594 0.800 0.400 N 1.142 6 residues pruned to eliminate duplicates Z: 23 23.258 2.362 0.796 0.335 0.909 0.409 CB 1.540 Z: 8 3.613 1.724 0.712 0.230 0.714 0.571 CB 0.887 Z: 20 29.649 2.183 0.401 0.921 1.000 1.000 CB 1.565 20 residues pruned to eliminate duplicates Z: 20 11.903 2.134 0.610 0.237 0.789 0.421 CB 1.366 20 residues pruned to eliminate duplicates Z: 15 28.782 2.463 0.726 0.662 0.929 0.857 CA 1.677 15 residues pruned to eliminate duplicates Z: 20 34.315 2.146 0.673 0.886 0.947 0.632 CA 1.670 20 residues pruned to eliminate duplicates Z: 10 11.784 1.529 0.851 0.722 1.000 0.556 N 1.136 Z: 6 4.729 1.802 0.543 0.375 0.800 0.400 N 1.086 6 residues pruned to eliminate duplicates Z: 26 63.869 2.471 1.315 0.889 0.920 0.360 CA 1.747 26 residues pruned to eliminate duplicates Z: 9 22.531 2.309 0.857 0.829 0.875 0.500 CB 1.598 9 residues pruned to eliminate duplicates Z: 20 75.149 2.703 1.291 0.930 1.000 0.579 CA 1.947 19 residues pruned to eliminate duplicates Z: 63 50.151 2.552 0.595 0.497 0.935 0.661 CB 1.678 63 residues pruned to eliminate duplicates Z: 21 51.131 2.497 1.092 0.891 0.900 0.450 CA 1.749 Z: 14 18.466 1.802 0.645 0.817 1.000 0.769 CA 1.312 14 residues pruned to eliminate duplicates Z: 19 39.765 2.447 0.642 0.885 0.944 0.722 CB 1.783 19 residues pruned to eliminate duplicates Z: 25 46.597 2.789 0.839 0.905 0.958 0.833 CA 1.378 25 residues pruned to eliminate duplicates Z: 9 13.819 1.859 0.467 0.787 0.875 0.250 N 1.591 9 residues pruned to eliminate duplicates Z: 13 18.929 2.060 0.536 0.751 0.917 0.667 CB 1.506 13 residues pruned to eliminate duplicates Z: 21 32.297 2.232 0.783 0.810 0.900 0.700 CA 1.539 21 residues pruned to eliminate duplicates Z: 104 52.099 2.463 0.660 0.426 0.893 0.641 CB 1.517 104 residues pruned to eliminate duplicates Z: 18 34.923 2.056 0.930 0.909 0.941 0.882 CB 1.610 18 residues pruned to eliminate duplicates Z: 11 15.738 2.536 0.738 0.632 0.800 0.800 CA 1.247 11 residues pruned to eliminate duplicates Z: 60 64.443 2.536 0.883 0.659 0.881 0.644 CA 1.720 60 residues pruned to eliminate duplicates Z: 48 25.352 2.167 0.532 0.435 0.851 0.617 CB 1.400 48 residues pruned to eliminate duplicates Z: 16 35.078 2.856 0.362 0.945 1.000 1.000 CA 1.611 16 residues pruned to eliminate duplicates Z: 6 4.712 1.725 0.449 0.518 0.800 0.400 CA 1.035 4 residues pruned to eliminate duplicates Z: 20 39.718 2.349 0.773 0.849 0.947 0.737 CA 1.712 20 residues pruned to eliminate duplicates Z: 19 50.831 2.426 0.959 0.911 1.000 0.889 CB 1.786 19 residues pruned to eliminate duplicates Z: 76 41.746 2.334 0.554 0.469 0.947 0.680 CB 1.448 76 residues pruned to eliminate duplicates Z: 6 3.133 1.532 0.766 0.437 0.600 0.400 C 0.921 Z: 6 2.835 1.534 0.951 0.297 0.600 0.400 O 0.885 Z: 11 6.929 1.853 0.293 0.349 0.900 0.500 CB 1.197 Z: 10 5.548 1.864 0.698 0.275 0.778 0.444 CB 0.969 Z: 20 36.550 2.376 0.639 0.845 0.947 0.737 CA 1.689 20 residues pruned to eliminate duplicates Z: 21 29.831 2.030 0.717 0.886 0.950 0.900 CB 1.454 21 residues pruned to eliminate duplicates Z: 69 67.077 2.566 0.993 0.557 0.897 0.544 CB 1.677 35 residues pruned to eliminate duplicates Z: 7 9.466 1.813 0.720 0.641 0.833 0.833 N 1.304 7 residues pruned to eliminate duplicates Z: 30 44.194 2.626 1.092 0.451 0.931 0.655 CA 1.688 30 residues pruned to eliminate duplicates Z: 8 9.642 1.707 0.344 0.897 1.000 1.000 CA 1.137 Z: 64 70.065 2.531 1.015 0.648 0.921 0.603 CB 1.638 59 residues pruned to eliminate duplicates Z: 9 30.316 2.498 1.231 0.886 1.000 1.000 CA 1.388 9 residues pruned to eliminate duplicates Z: 23 18.125 2.188 0.453 0.397 0.909 0.591 CB 1.490 23 residues pruned to eliminate duplicates Z: 95 48.518 2.425 0.695 0.431 0.894 0.638 CB 1.463 95 residues pruned to eliminate duplicates Z: 21 39.587 2.182 0.838 0.933 1.000 0.900 CB 1.540 21 residues pruned to eliminate duplicates Z: 9 9.462 2.060 0.639 0.721 0.875 0.875 CB 0.927 Z: 6 6.916 1.488 0.654 0.778 1.000 0.600 N 0.984 Z: 23 14.264 2.106 0.287 0.414 0.909 0.545 CB 1.350 23 residues pruned to eliminate duplicates Z: 57 84.543 2.590 1.219 0.696 0.946 0.518 CB 1.736 57 residues pruned to eliminate duplicates Z: 13 24.992 2.421 0.228 0.852 1.000 0.750 CA 1.795 13 residues pruned to eliminate duplicates Z: 72 41.444 2.237 0.636 0.486 0.901 0.465 CB 1.513 72 residues pruned to eliminate duplicates Z: 9 21.329 2.195 0.983 0.770 0.875 0.625 CA 1.560 7 residues pruned to eliminate duplicates Z: 18 37.521 2.516 0.548 0.908 0.941 0.882 CB 1.763 18 residues pruned to eliminate duplicates 8 1.363 1.860 -0.277 0.336 0.714 0.429 CB 0.641 ? Z: 20 33.085 2.198 0.609 0.894 1.000 0.842 CB 1.540 20 residues pruned to eliminate duplicates Z: 16 8.729 2.022 0.441 0.382 0.667 0.533 CB 1.316 Z: 20 27.637 2.167 0.411 0.816 1.000 0.737 CA 1.577 20 residues pruned to eliminate duplicates Z: 12 27.443 2.136 0.959 0.888 0.909 0.818 CB 1.567 12 residues pruned to eliminate duplicates Z: 68 32.024 2.301 0.577 0.432 0.881 0.597 CB 1.313 70 residues pruned to eliminate duplicates Z: 35 40.831 2.488 1.000 0.445 0.882 0.618 CB 1.688 35 residues pruned to eliminate duplicates Z: 6 3.174 1.703 -0.056 0.767 0.800 0.800 CB 0.872 Z: 101 41.147 2.269 0.556 0.430 0.930 0.600 CB 1.347 101 residues pruned to eliminate duplicates Z: 55 47.566 2.378 0.651 0.473 0.963 0.685 CB 1.759 55 residues pruned to eliminate duplicates Z: 21 31.311 2.482 1.063 0.475 0.900 0.600 CB 1.558 21 residues pruned to eliminate duplicates Z: 24 55.588 2.587 0.886 0.888 0.957 0.826 CA 1.789 24 residues pruned to eliminate duplicates Z: 48 53.624 2.459 0.959 0.673 0.894 0.553 CB 1.549 43 residues pruned to eliminate duplicates Z: 13 17.092 1.918 0.880 0.788 0.917 0.583 CB 1.160 10 residues pruned to eliminate duplicates Z: 7 7.996 2.395 0.512 0.217 0.833 0.500 CB 1.508 8 residues pruned to eliminate duplicates Z: 82 53.176 2.590 0.609 0.475 0.877 0.642 CB 1.660 82 residues pruned to eliminate duplicates Z: 20 39.046 2.454 0.665 0.879 1.000 0.895 CA 1.590 20 residues pruned to eliminate duplicates Z: 26 53.612 2.529 0.948 0.885 0.920 0.760 CA 1.709 26 residues pruned to eliminate duplicates Z: 18 40.861 2.455 0.824 0.910 0.941 0.824 CB 1.668 18 residues pruned to eliminate duplicates Z: 10 28.949 2.197 0.944 0.880 1.000 0.889 CB 1.637 14 residues pruned to eliminate duplicates Z: 12 16.173 1.960 0.684 0.824 0.818 0.727 CB 1.364 12 residues pruned to eliminate duplicates Z: 13 28.684 2.018 1.059 0.863 0.917 0.833 CB 1.596 13 residues pruned to eliminate duplicates Z: 11 30.266 2.086 0.999 0.885 1.000 0.700 CA 1.658 11 residues pruned to eliminate duplicates Z: 19 29.050 2.217 0.344 0.897 0.944 0.889 CB 1.743 19 residues pruned to eliminate duplicates Z: 23 12.323 2.135 0.411 0.318 0.909 0.455 CB 1.173 23 residues pruned to eliminate duplicates Z: 35 75.132 2.679 1.249 0.786 0.941 0.647 CB 1.766 35 residues pruned to eliminate duplicates Z: 6 6.764 2.011 0.528 0.466 0.800 0.400 CB 1.275 6 residues pruned to eliminate duplicates Z: 14 18.168 2.034 0.385 0.825 0.846 0.462 CA 1.595 14 residues pruned to eliminate duplicates Z: 12 12.772 2.360 0.439 0.475 0.818 0.727 CB 1.422 12 residues pruned to eliminate duplicates Z: 7 2.459 2.292 -0.113 0.231 0.667 0.333 CB 1.014 5 residues pruned to eliminate duplicates Z: 6 8.723 1.912 1.808 0.790 0.400 0.200 CB 1.408 6 residues pruned to eliminate duplicates Z: 21 22.273 2.191 0.174 0.896 0.950 0.900 CB 1.459 21 residues pruned to eliminate duplicates Z: 6 5.602 1.311 0.735 0.585 1.000 0.400 CB 1.016 6 residues pruned to eliminate duplicates Z: 32 26.203 2.302 0.814 0.385 0.935 0.645 CB 1.361 32 residues pruned to eliminate duplicates Z: 8 13.599 1.978 0.377 0.846 1.000 0.857 CB 1.403 7 residues pruned to eliminate duplicates Z: 46 32.659 2.205 0.648 0.514 0.911 0.689 CB 1.450 46 residues pruned to eliminate duplicates Z: 7 16.653 2.522 0.249 0.817 1.000 0.833 CB 1.639 7 residues pruned to eliminate duplicates Z: 46 39.623 2.336 0.655 0.528 0.867 0.533 CB 1.715 46 residues pruned to eliminate duplicates Z: 6 12.656 2.100 0.718 0.767 1.000 0.800 CB 1.238 Z: 18 11.673 2.280 0.617 0.289 0.824 0.471 CB 1.182 18 residues pruned to eliminate duplicates Z: 6 2.809 1.652 0.083 0.831 1.000 0.800 CB 0.527 Z: 7 9.478 2.042 0.777 0.591 0.833 0.667 CB 1.173 7 residues pruned to eliminate duplicates Z: 7 6.313 1.741 0.706 0.409 0.833 0.667 CA 1.145 Z: 27 44.407 2.528 0.805 0.679 0.923 0.577 CA 1.753 27 residues pruned to eliminate duplicates Z: 69 72.148 2.583 1.069 0.616 0.897 0.647 CB 1.635 69 residues pruned to eliminate duplicates Z: 17 42.071 2.487 0.930 0.859 1.000 0.688 CA 1.612 17 residues pruned to eliminate duplicates Z: 39 47.762 2.460 0.879 0.649 0.921 0.711 CA 1.584 41 residues pruned to eliminate duplicates Z: 64 49.644 2.328 0.656 0.658 0.921 0.603 CB 1.523 64 residues pruned to eliminate duplicates Z: 8 20.636 2.093 1.065 0.809 1.000 0.429 CA 1.379 8 residues pruned to eliminate duplicates Z: 47 47.810 2.503 0.936 0.454 0.870 0.587 CA 1.753 47 residues pruned to eliminate duplicates Z: 43 67.802 2.658 0.925 0.770 0.881 0.619 CB 1.827 43 residues pruned to eliminate duplicates Z: 21 31.143 2.265 0.395 0.861 1.000 0.750 CB 1.618 21 residues pruned to eliminate duplicates 6 1.438 1.763 -0.107 0.610 0.800 0.600 CB 0.460 ? Z: 19 38.650 2.254 0.868 0.933 1.000 0.944 CB 1.510 19 residues pruned to eliminate duplicates Z: 12 15.378 1.841 0.423 0.863 0.909 0.818 CB 1.428 12 residues pruned to eliminate duplicates Z: 7 7.444 1.801 1.130 0.389 0.667 0.333 N 1.337 Z: 6 11.892 2.256 0.692 0.629 0.800 0.400 CA 1.542 6 residues pruned to eliminate duplicates Z: 16 21.896 2.147 0.300 0.858 1.000 0.733 CA 1.492 16 residues pruned to eliminate duplicates Z: 21 28.204 2.503 0.482 0.798 0.950 0.900 CA 1.379 21 residues pruned to eliminate duplicates Z: 6 2.464 1.565 0.798 0.284 0.600 0.000 CA 0.833 Z: 10 5.055 1.812 0.632 0.720 0.889 0.889 CB 0.525 Z: 6 9.435 1.661 0.509 0.783 1.000 0.800 CA 1.313 Z: 10 7.062 1.962 0.457 0.403 0.889 0.333 CB 1.026 Z: 22 28.658 2.453 0.563 0.546 0.857 0.714 CB 1.819 22 residues pruned to eliminate duplicates Z: 11 15.155 2.073 0.469 0.862 0.900 0.700 CB 1.284 11 residues pruned to eliminate duplicates Z: 6 9.049 1.698 0.744 0.822 1.000 0.800 CA 1.033 Z: 35 51.736 2.463 1.037 0.634 0.912 0.765 CA 1.711 35 residues pruned to eliminate duplicates Z: 19 25.499 2.059 0.750 0.776 0.833 0.778 CB 1.569 19 residues pruned to eliminate duplicates Z: 11 24.183 2.382 1.210 0.720 0.700 0.400 CB 1.701 11 residues pruned to eliminate duplicates Z: 98 72.513 2.466 0.679 0.561 0.928 0.629 CA 1.807 98 residues pruned to eliminate duplicates Z: 8 15.494 2.079 0.359 0.772 1.000 0.857 CA 1.629 8 residues pruned to eliminate duplicates Z: 10 26.528 2.047 0.935 0.844 1.000 0.556 N 1.660 10 residues pruned to eliminate duplicates Z: 19 30.177 2.232 0.400 0.899 0.944 0.833 CB 1.723 19 residues pruned to eliminate duplicates Z: 19 21.701 2.294 0.776 0.443 0.833 0.500 CB 1.598 19 residues pruned to eliminate duplicates Z: 14 7.107 1.899 0.395 0.259 0.846 0.538 CB 1.158 14 residues pruned to eliminate duplicates Z: 6 4.000 1.959 0.286 0.674 0.800 0.600 CB 0.756 6 residues pruned to eliminate duplicates Z: 104 61.149 2.390 0.694 0.519 0.913 0.612 CB 1.600 104 residues pruned to eliminate duplicates Z: 20 38.523 2.284 0.743 0.887 0.947 0.842 CA 1.690 20 residues pruned to eliminate duplicates Z: 59 76.592 2.592 1.123 0.689 0.897 0.621 CB 1.714 59 residues pruned to eliminate duplicates Z: 26 59.957 2.683 1.028 0.929 1.000 0.880 CA 1.542 26 residues pruned to eliminate duplicates Z: 10 15.587 2.015 0.729 0.708 0.778 0.444 N 1.587 10 residues pruned to eliminate duplicates Z: 17 20.148 2.319 0.463 0.435 0.938 0.688 CB 1.695 15 residues pruned to eliminate duplicates Z: 9 19.306 2.087 0.860 0.773 0.875 0.500 CB 1.580 9 residues pruned to eliminate duplicates Z: 20 31.135 2.165 0.390 0.885 1.000 0.789 CA 1.714 20 residues pruned to eliminate duplicates Z: 12 14.479 2.114 0.229 0.691 0.909 0.909 CB 1.551 12 residues pruned to eliminate duplicates Z: 7 5.673 2.029 0.123 0.564 0.833 0.500 CB 1.147 Z: 36 87.235 2.736 1.300 0.758 0.971 0.571 CB 1.918 36 residues pruned to eliminate duplicates Z: 24 62.880 2.889 1.236 0.917 0.957 0.826 CA 1.497 24 residues pruned to eliminate duplicates Z: 8 10.101 2.193 0.487 0.558 0.714 0.429 CA 1.548 8 residues pruned to eliminate duplicates Z: 7 8.465 1.825 0.562 0.796 0.833 0.500 CA 1.122 7 residues pruned to eliminate duplicates Z: 21 22.644 2.267 0.430 0.493 0.850 0.500 N 1.851 21 residues pruned to eliminate duplicates Z: 18 29.967 2.032 0.638 0.896 1.000 0.765 CB 1.565 18 residues pruned to eliminate duplicates Z: 25 48.042 2.512 1.010 0.911 0.958 0.750 CA 1.437 25 residues pruned to eliminate duplicates Z: 22 72.026 2.692 1.249 0.899 1.000 0.762 CA 1.856 22 residues pruned to eliminate duplicates Z: 20 37.617 2.436 0.607 0.897 1.000 0.947 CA 1.579 20 residues pruned to eliminate duplicates Z: 53 31.280 2.094 0.614 0.496 0.923 0.712 CB 1.395 53 residues pruned to eliminate duplicates Z: 7 3.143 1.466 1.228 0.247 0.667 0.333 CB 0.788 Z: 28 47.118 2.656 1.150 0.527 0.889 0.630 CB 1.739 28 residues pruned to eliminate duplicates Z: 9 7.160 1.854 0.505 0.594 0.875 0.375 CB 0.947 Z: 16 47.092 2.644 1.285 0.879 0.800 0.533 CA 1.823 16 residues pruned to eliminate duplicates Z: 9 7.514 1.752 0.928 0.525 0.625 0.625 N 1.227 Z: 20 39.072 2.531 0.825 0.909 1.000 0.842 CA 1.377 22 residues pruned to eliminate duplicates Z: 38 41.278 2.651 0.596 0.496 0.946 0.676 CB 1.701 38 residues pruned to eliminate duplicates Z: 85 58.698 2.411 0.760 0.475 0.905 0.667 CB 1.711 85 residues pruned to eliminate duplicates Z: 10 6.086 2.013 0.336 0.331 0.889 0.444 CB 1.021 Z: 8 8.469 2.086 0.488 0.692 0.857 0.571 N 1.009 Z: 6 4.761 2.146 0.504 0.483 0.800 0.600 CB 0.838 5 residues pruned to eliminate duplicates Z: 7 3.565 1.961 0.177 0.615 0.833 0.667 CB 0.679 Z: 21 34.986 2.020 0.998 0.904 1.000 0.850 CB 1.381 21 residues pruned to eliminate duplicates Z: 6 8.470 1.717 0.532 0.791 1.000 0.800 N 1.116 Z: 19 22.851 2.354 0.159 0.922 0.944 0.944 CA 1.470 19 residues pruned to eliminate duplicates Z: 9 21.845 1.988 1.316 0.772 0.875 0.625 CA 1.507 9 residues pruned to eliminate duplicates 6 -0.227 1.986 0.637 0.874 1.000 0.800 CB-0.023 ? Z: 9 14.281 2.013 0.603 0.792 0.875 0.875 CB 1.384 9 residues pruned to eliminate duplicates Z: 21 31.855 2.155 0.584 0.835 0.950 0.850 CA 1.645 21 residues pruned to eliminate duplicates Z: 29 24.675 2.212 0.539 0.598 0.893 0.571 CB 1.398 29 residues pruned to eliminate duplicates Z: 7 2.706 1.700 0.420 0.337 0.500 0.333 CA 1.093 Z: 6 6.784 1.567 0.762 0.822 1.000 0.800 CA 0.831 Z: 62 43.427 2.333 0.809 0.472 0.902 0.623 CB 1.504 89 residues pruned to eliminate duplicates Z: 10 19.005 2.134 0.619 0.862 0.889 0.333 CB 1.515 10 residues pruned to eliminate duplicates Z: 8 11.445 1.917 0.095 0.823 1.000 0.857 O 1.557 8 residues pruned to eliminate duplicates Z: 31 24.120 2.258 0.510 0.389 0.933 0.500 CB 1.557 31 residues pruned to eliminate duplicates Z: 12 13.065 1.747 0.143 0.879 1.000 0.909 CB 1.430 12 residues pruned to eliminate duplicates Z: 62 45.474 2.295 0.787 0.541 0.885 0.672 CB 1.540 62 residues pruned to eliminate duplicates Z: 12 15.702 2.029 0.193 0.890 1.000 0.909 CA 1.408 12 residues pruned to eliminate duplicates Z: 12 4.252 1.763 0.301 0.110 0.636 0.182 CA 1.438 12 residues pruned to eliminate duplicates Z: 34 28.930 2.177 0.736 0.573 0.848 0.667 CB 1.463 34 residues pruned to eliminate duplicates Z: 41 65.995 2.586 0.932 0.757 0.900 0.550 CB 1.846 41 residues pruned to eliminate duplicates Z: 34 37.906 2.538 0.544 0.661 0.909 0.697 CB 1.595 44 residues pruned to eliminate duplicates Z: 109 101.459 2.691 0.990 0.621 0.898 0.611 CA 1.811 109 residues pruned to eliminate duplicates Z: 69 74.378 2.570 0.945 0.597 0.926 0.721 CB 1.776 69 residues pruned to eliminate duplicates Z: 20 12.826 2.071 0.378 0.374 0.842 0.526 CB 1.401 Z: 21 34.633 2.238 0.483 0.898 1.000 0.850 CB 1.670 21 residues pruned to eliminate duplicates Z: 20 47.335 2.389 0.909 0.880 1.000 0.632 CA 1.726 20 residues pruned to eliminate duplicates Z: 21 35.282 2.268 0.880 0.862 0.950 0.750 CB 1.431 21 residues pruned to eliminate duplicates Z: 6 7.818 2.056 0.531 0.612 0.800 0.600 CB 1.249 Z: 10 5.664 1.941 0.375 0.326 0.889 0.556 CB 0.963 8 residues pruned to eliminate duplicates Z: 29 24.864 2.117 0.994 0.405 0.821 0.679 CB 1.497 29 residues pruned to eliminate duplicates Z: 12 13.784 1.932 0.802 0.858 0.909 0.545 CB 0.967 12 residues pruned to eliminate duplicates Z: 6 2.915 1.882 0.012 0.785 1.000 0.800 CB 0.533 Z: 9 18.847 2.062 0.561 0.824 1.000 0.750 CA 1.564 9 residues pruned to eliminate duplicates Z: 37 18.074 2.035 0.560 0.353 0.806 0.556 CB 1.381 37 residues pruned to eliminate duplicates Z: 9 11.241 1.861 0.409 0.845 0.875 0.750 CA 1.288 9 residues pruned to eliminate duplicates Z: 8 19.579 2.254 0.581 0.819 1.000 0.714 CB 1.574 8 residues pruned to eliminate duplicates Z: 9 4.204 1.838 0.349 0.292 0.750 0.250 CB 1.009 Z: 19 35.611 2.347 0.705 0.857 0.944 0.889 CA 1.636 19 residues pruned to eliminate duplicates Z: 6 14.560 2.368 0.674 0.719 1.000 1.000 CA 1.348 6 residues pruned to eliminate duplicates Z: 20 36.643 2.357 0.569 0.892 1.000 0.737 CA 1.633 20 residues pruned to eliminate duplicates Z: 62 50.301 2.481 0.566 0.525 0.951 0.607 CB 1.701 62 residues pruned to eliminate duplicates Z: 10 5.781 2.382 0.507 0.375 0.667 0.667 CB 0.920 10 residues pruned to eliminate duplicates Z: 6 11.636 1.949 1.087 0.755 0.800 0.200 CB 1.274 5 residues pruned to eliminate duplicates Z: 26 20.633 2.215 0.466 0.444 0.920 0.600 CB 1.464 26 residues pruned to eliminate duplicates Z: 6 9.163 2.193 0.367 0.652 0.800 0.600 CA 1.482 Z: 6 2.069 1.571 0.700 0.470 0.800 0.600 CB 0.446 Z: 6 2.439 1.356 0.705 0.395 0.800 0.600 CB 0.659 Z: 47 80.013 2.658 1.142 0.723 0.957 0.522 CB 1.771 47 residues pruned to eliminate duplicates Z: 29 53.692 2.511 1.059 0.673 0.893 0.679 CA 1.873 29 residues pruned to eliminate duplicates Z: 132 115.509 2.649 1.004 0.632 0.901 0.588 CA 1.863 132 residues pruned to eliminate duplicates Z: 10 12.744 2.187 0.703 0.445 0.778 0.444 CB 1.551 Z: 54 32.509 2.222 0.480 0.545 0.868 0.698 CB 1.497 54 residues pruned to eliminate duplicates Z: 9 9.244 2.111 0.319 0.599 1.000 0.625 CB 1.069 10 residues pruned to eliminate duplicates Z: 19 26.690 2.169 0.294 0.859 0.944 0.722 CB 1.747 19 residues pruned to eliminate duplicates Z: 13 24.891 2.006 0.720 0.858 0.917 0.500 N 1.673 13 residues pruned to eliminate duplicates Z: 27 33.963 2.226 0.856 0.632 0.846 0.769 CB 1.683 27 residues pruned to eliminate duplicates Z: 53 49.335 2.459 0.791 0.465 0.942 0.519 CA 1.708 118 residues pruned to eliminate duplicates Z: 21 34.463 2.244 0.726 0.898 0.950 0.800 CB 1.499 21 residues pruned to eliminate duplicates Z: 12 16.746 1.849 0.442 0.848 1.000 0.545 CB 1.404 12 residues pruned to eliminate duplicates Z: 64 75.212 2.732 0.987 0.570 0.857 0.619 CA 1.903 64 residues pruned to eliminate duplicates Z: 47 37.443 2.451 0.816 0.328 0.870 0.630 CB 1.723 47 residues pruned to eliminate duplicates Z: 49 78.607 2.603 1.189 0.740 0.896 0.500 CB 1.793 49 residues pruned to eliminate duplicates Z: 14 16.394 1.729 0.798 0.774 0.846 0.538 CB 1.357 13 residues pruned to eliminate duplicates Z: 6 4.846 2.044 1.543 0.540 0.600 0.600 CB 0.668 Z: 41 41.716 2.436 0.611 0.575 0.925 0.700 CB 1.690 41 residues pruned to eliminate duplicates Z: 8 3.775 2.108 0.002 0.440 0.857 0.714 CB 0.838 7 residues pruned to eliminate duplicates 6 1.009 1.747 0.770 0.481 0.800 0.400 CB 0.186 ? Z: 8 6.626 1.326 1.003 0.800 0.857 0.571 CA 0.846 8 residues pruned to eliminate duplicates Z: 8 6.928 1.832 0.212 0.723 0.857 0.429 CB 1.125 Z: 12 24.814 1.988 0.674 0.863 1.000 0.818 N 1.650 Z: 49 52.241 2.609 0.615 0.511 0.979 0.646 CA 1.807 66 residues pruned to eliminate duplicates Z: 8 12.307 2.247 0.417 0.700 1.000 0.714 CB 1.218 Z: 121 85.503 2.540 0.722 0.629 0.883 0.608 CB 1.789 121 residues pruned to eliminate duplicates Z: 6 2.069 1.586 0.146 0.601 0.800 0.800 CB 0.578 Z: 6 7.181 1.788 0.153 0.847 1.000 1.000 CA 1.157 6 residues pruned to eliminate duplicates Z: 26 16.125 2.242 0.461 0.378 0.800 0.520 CB 1.402 26 residues pruned to eliminate duplicates Z: 26 60.219 2.530 0.971 0.869 1.000 0.760 CA 1.764 26 residues pruned to eliminate duplicates Z: 6 7.117 1.955 0.282 0.707 0.800 0.600 CB 1.315 6 residues pruned to eliminate duplicates Z: 16 18.358 2.012 0.712 0.728 0.800 0.533 CB 1.401 16 residues pruned to eliminate duplicates Z: 36 26.936 2.116 0.484 0.655 0.829 0.629 CB 1.516 27 residues pruned to eliminate duplicates Z: 10 13.824 2.188 0.488 0.536 0.889 0.556 CB 1.537 10 residues pruned to eliminate duplicates Z: 11 15.371 1.910 0.270 0.889 1.000 0.800 CB 1.442 11 residues pruned to eliminate duplicates Z: 13 9.725 1.999 0.493 0.465 0.833 0.750 CB 1.170 13 residues pruned to eliminate duplicates Z: 6 2.729 2.027 -0.283 0.475 0.800 0.400 CB 1.077 6 residues pruned to eliminate duplicates Z: 12 13.002 1.835 0.462 0.866 0.909 0.727 CB 1.177 12 residues pruned to eliminate duplicates Z: 37 25.936 2.271 0.488 0.500 0.833 0.639 CB 1.536 37 residues pruned to eliminate duplicates Z: 12 20.324 2.253 0.915 0.504 0.909 0.545 CB 1.556 Z: 9 8.140 2.121 0.226 0.347 0.875 0.750 CA 1.493 9 residues pruned to eliminate duplicates Z: 6 8.617 1.586 0.859 0.819 0.800 0.800 N 1.239 Z: 24 75.251 2.724 1.330 0.937 1.000 0.739 CA 1.721 24 residues pruned to eliminate duplicates Z: 67 54.158 2.344 0.749 0.627 0.924 0.576 CB 1.562 67 residues pruned to eliminate duplicates Z: 17 45.698 2.708 0.978 0.881 0.938 0.875 CA 1.646 17 residues pruned to eliminate duplicates Z: 15 30.863 2.186 0.681 0.903 1.000 0.786 CB 1.599 15 residues pruned to eliminate duplicates Z: 22 10.827 1.982 0.491 0.274 0.810 0.524 CB 1.275 13 residues pruned to eliminate duplicates Z: 12 25.039 2.201 0.682 0.880 0.909 0.636 CB 1.626 12 residues pruned to eliminate duplicates Z: 27 69.641 2.736 1.195 0.829 0.962 0.615 CB 1.780 27 residues pruned to eliminate duplicates Z: 14 10.614 2.257 0.645 0.307 0.769 0.462 CB 1.278 14 residues pruned to eliminate duplicates Z: 6 4.855 1.929 0.099 0.398 1.000 0.600 CB 1.141 Z: 6 7.712 2.003 0.650 0.719 0.800 0.600 CB 1.070 6 residues pruned to eliminate duplicates Z: 120 97.960 2.629 0.894 0.598 0.908 0.597 CA 1.810 126 residues pruned to eliminate duplicates Z: 6 4.911 1.746 0.440 0.288 1.000 0.600 CB 1.109 6 residues pruned to eliminate duplicates Z: 14 6.640 1.800 0.516 0.325 0.692 0.308 CB 1.181 6 residues pruned to eliminate duplicates Z: 10 3.769 1.890 0.432 0.379 0.667 0.333 CB 0.792 6 1.538 1.771 0.485 0.296 0.600 0.400 CB 0.548 ? Z: 44 31.521 2.450 0.676 0.452 0.860 0.581 CB 1.429 44 residues pruned to eliminate duplicates Z: 20 48.655 2.409 0.985 0.876 1.000 0.789 CA 1.696 20 residues pruned to eliminate duplicates Z: 14 14.120 2.072 0.328 0.553 0.846 0.692 N 1.596 14 residues pruned to eliminate duplicates Z: 19 39.540 2.491 0.606 0.913 0.944 0.833 CA 1.747 19 residues pruned to eliminate duplicates Z: 9 7.702 1.739 0.271 0.767 1.000 0.500 CB 0.972 Z: 44 51.410 2.487 0.881 0.531 0.907 0.605 CB 1.792 123 residues pruned to eliminate duplicates Z: 7 7.719 1.649 0.244 0.869 1.000 0.667 CA 1.122 7 residues pruned to eliminate duplicates Z: 6 3.890 1.517 0.417 0.479 0.800 0.400 CB 1.033 Z: 19 41.795 2.521 0.691 0.887 1.000 0.833 CA 1.666 19 residues pruned to eliminate duplicates Z: 17 37.007 2.550 0.612 0.896 0.938 0.875 CA 1.719 17 residues pruned to eliminate duplicates Z: 9 19.288 2.340 1.208 0.820 0.875 0.500 CA 1.143 9 residues pruned to eliminate duplicates Z: 11 21.432 2.283 0.889 0.754 0.800 0.800 CB 1.566 11 residues pruned to eliminate duplicates Z: 19 18.868 2.188 0.715 0.348 0.944 0.667 CB 1.479 19 residues pruned to eliminate duplicates Z: 6 5.260 1.874 -0.122 0.782 1.000 0.800 CB 1.115 Z: 103 64.202 2.425 0.699 0.530 0.902 0.667 CB 1.662 103 residues pruned to eliminate duplicates Z: 36 52.956 2.502 1.294 0.706 0.829 0.371 CB 1.560 36 residues pruned to eliminate duplicates Z: 34 63.077 2.637 1.252 0.748 0.848 0.485 CB 1.746 34 residues pruned to eliminate duplicates Z: 20 51.071 2.518 1.029 0.874 0.947 0.474 CA 1.761 Z: 12 5.610 1.364 0.799 0.518 0.818 0.455 O 0.828 Z: 38 44.419 2.571 0.958 0.453 0.784 0.595 CA 1.941 46 residues pruned to eliminate duplicates Z: 10 18.379 2.120 0.588 0.877 1.000 0.667 CB 1.321 10 residues pruned to eliminate duplicates Z: 38 24.500 2.293 0.305 0.426 0.919 0.541 CB 1.582 Z: 11 9.283 2.254 0.450 0.538 0.800 0.600 CB 1.081 19 residues pruned to eliminate duplicates Z: 8 2.884 1.626 0.374 0.419 0.714 0.286 CB 0.743 Z: 13 13.276 2.130 0.509 0.376 0.917 0.333 CB 1.484 12 residues pruned to eliminate duplicates Z: 12 12.190 2.071 0.567 0.734 0.818 0.364 CB 1.122 12 residues pruned to eliminate duplicates Z: 7 6.286 1.771 0.499 0.331 1.000 0.167 CA 1.163 Z: 11 22.368 1.959 1.011 0.862 0.900 0.600 CB 1.465 11 residues pruned to eliminate duplicates Z: 39 27.674 2.172 0.625 0.530 0.895 0.553 CB 1.380 17 residues pruned to eliminate duplicates Z: 98 35.965 2.216 0.512 0.354 0.856 0.526 CB 1.492 70 residues pruned to eliminate duplicates Z: 9 4.131 1.877 0.507 0.307 0.625 0.500 CB 1.023 Z: 6 13.154 2.333 0.701 0.820 0.800 0.600 CA 1.404 6 residues pruned to eliminate duplicates Z: 38 33.792 2.338 0.627 0.615 0.865 0.595 CB 1.515 38 residues pruned to eliminate duplicates Z: 39 38.038 2.224 0.838 0.551 0.868 0.605 CA 1.654 39 residues pruned to eliminate duplicates Z: 7 6.074 1.679 0.191 0.818 1.000 0.333 CB 0.941 7 residues pruned to eliminate duplicates Z: 10 11.290 1.780 0.424 0.735 0.889 0.444 CB 1.353 Z: 22 33.842 2.152 0.817 0.885 0.952 0.714 CB 1.432 22 residues pruned to eliminate duplicates Z: 8 9.118 2.063 0.739 0.431 0.714 0.429 CB 1.444 8 residues pruned to eliminate duplicates Z: 23 24.493 2.338 0.485 0.521 0.955 0.727 CB 1.543 23 residues pruned to eliminate duplicates Z: 19 32.831 2.332 0.432 0.919 1.000 0.944 CB 1.633 19 residues pruned to eliminate duplicates Z: 67 33.926 2.077 0.684 0.488 0.864 0.636 CB 1.400 67 residues pruned to eliminate duplicates Z: 7 5.318 2.268 0.398 0.819 1.000 0.667 CB 0.519 7 residues pruned to eliminate duplicates Z: 51 55.184 2.563 0.653 0.615 0.920 0.720 CB 1.795 51 residues pruned to eliminate duplicates Z: 13 27.192 2.058 0.811 0.866 1.000 0.750 CB 1.542 13 residues pruned to eliminate duplicates Z: 8 14.928 1.943 0.853 0.857 0.857 0.857 CB 1.348 8 residues pruned to eliminate duplicates Z: 16 24.533 2.322 0.817 0.461 0.933 0.667 CB 1.675 16 residues pruned to eliminate duplicates Z: 9 2.512 1.903 -0.345 0.260 0.750 0.500 CB 1.250 Z: 55 50.438 2.433 0.729 0.524 0.944 0.537 CB 1.688 46 residues pruned to eliminate duplicates Z: 13 8.346 1.720 0.613 0.398 0.750 0.417 CA 1.289 Z: 29 22.098 2.228 0.522 0.474 0.893 0.643 CB 1.416 29 residues pruned to eliminate duplicates Z: 180 83.388 2.424 0.679 0.468 0.916 0.665 CB 1.727 248 residues pruned to eliminate duplicates Z: 20 54.711 2.789 0.969 0.792 0.947 0.789 CA 1.868 20 residues pruned to eliminate duplicates Z: 40 81.933 2.664 1.204 0.782 0.949 0.641 CB 1.837 40 residues pruned to eliminate duplicates Z: 73 51.427 2.476 0.677 0.498 0.847 0.542 CB 1.727 73 residues pruned to eliminate duplicates Z: 9 12.907 2.005 0.579 0.459 1.000 0.625 CB 1.504 9 residues pruned to eliminate duplicates 6 0.849 1.616 0.687 0.513 0.600 0.400 CA 0.229 ? Z: 10 7.312 1.733 0.703 0.393 0.889 0.444 CB 1.040 10 residues pruned to eliminate duplicates Z: 6 6.678 1.961 0.670 0.622 0.800 0.600 CB 1.017 Z: 76 54.403 2.475 0.665 0.463 0.920 0.587 CB 1.721 76 residues pruned to eliminate duplicates Z: 8 2.138 1.735 0.287 0.297 0.714 0.571 CB 0.635 Z: 11 8.051 1.838 0.662 0.430 0.900 0.400 CB 0.995 Z: 10 6.047 1.664 0.493 0.464 0.667 0.333 N 1.263 Z: 36 17.607 2.068 0.447 0.340 0.943 0.543 CB 1.256 10 residues pruned to eliminate duplicates Z: 8 10.682 1.941 0.581 0.716 0.857 0.571 CB 1.263 8 residues pruned to eliminate duplicates Z: 12 21.582 2.350 1.093 0.854 0.727 0.455 CB 1.344 12 residues pruned to eliminate duplicates Z: 22 51.586 2.530 1.462 0.816 0.905 0.524 CB 1.517 22 residues pruned to eliminate duplicates Z: 13 13.113 1.749 0.276 0.821 1.000 0.667 CB 1.284 13 residues pruned to eliminate duplicates Z: 14 4.528 1.820 0.473 0.174 0.692 0.231 CB 1.004 14 residues pruned to eliminate duplicates Z: 24 22.519 2.487 0.679 0.467 0.783 0.522 CB 1.485 24 residues pruned to eliminate duplicates Z: 7 4.175 1.676 0.653 0.369 0.833 0.333 CB 0.849 Z: 11 9.089 2.012 0.568 0.535 0.700 0.500 CB 1.257 11 residues pruned to eliminate duplicates Z: 9 2.607 1.735 0.646 0.219 0.375 0.250 CB 1.196 Z: 19 45.689 2.256 1.041 0.876 1.000 0.778 CB 1.699 26 residues pruned to eliminate duplicates Z: 8 9.672 2.311 0.296 0.344 0.857 0.286 CB 1.687 10 residues pruned to eliminate duplicates Z: 58 38.011 2.364 0.560 0.490 0.912 0.632 CB 1.512 58 residues pruned to eliminate duplicates Z: 29 36.812 2.412 0.949 0.475 0.929 0.714 CB 1.635 29 residues pruned to eliminate duplicates Z: 6 4.187 1.701 0.583 0.296 0.800 0.400 CA 1.091 6 residues pruned to eliminate duplicates Z: 8 4.031 1.449 0.395 0.653 0.714 0.571 CA 0.915 8 residues pruned to eliminate duplicates Z: 9 13.967 1.873 0.734 0.846 0.875 0.875 CB 1.291 9 residues pruned to eliminate duplicates Z: 6 3.583 1.472 0.390 0.461 0.800 0.600 O 1.019 6 residues pruned to eliminate duplicates Z: 26 74.999 2.667 1.598 0.912 1.000 0.680 CA 1.533 26 residues pruned to eliminate duplicates Z: 11 10.573 2.369 0.405 0.421 0.800 0.700 CB 1.363 Z: 6 3.476 1.630 0.512 0.294 0.800 0.400 CB 0.992 Z: 19 46.026 2.239 1.139 0.912 1.000 0.833 CB 1.604 19 residues pruned to eliminate duplicates Z: 7 6.816 1.819 0.409 0.445 0.833 0.833 N 1.379 3 residues pruned to eliminate duplicates Z: 10 6.448 1.682 0.355 0.456 0.778 0.333 CB 1.268 8 residues pruned to eliminate duplicates Z: 6 3.904 1.592 0.136 0.733 0.800 0.400 CA 0.979 6 residues pruned to eliminate duplicates Z: 56 32.150 2.223 0.512 0.451 0.909 0.636 CB 1.493 56 residues pruned to eliminate duplicates Z: 97 70.155 2.524 0.730 0.505 0.885 0.646 CB 1.843 122 residues pruned to eliminate duplicates Z: 6 6.621 1.933 0.068 0.727 0.800 0.600 CB 1.461 6 residues pruned to eliminate duplicates Z: 9 9.696 1.887 0.770 0.531 0.875 0.500 CB 1.138 Z: 7 10.649 2.001 0.177 0.822 1.000 0.667 CA 1.395 7 residues pruned to eliminate duplicates Z: 7 2.925 1.638 0.376 0.389 1.000 0.500 CB 0.596 Z: 33 34.089 2.349 0.616 0.595 0.938 0.625 CB 1.546 33 residues pruned to eliminate duplicates Z: 6 6.618 2.434 0.475 0.706 1.000 0.600 CB 0.683 6 residues pruned to eliminate duplicates Z: 8 3.649 1.797 0.089 0.477 0.857 0.571 CB 0.841 7 residues pruned to eliminate duplicates Z: 14 14.192 1.995 0.823 0.623 0.923 0.538 CB 1.044 15 residues pruned to eliminate duplicates Z: 11 5.950 1.740 0.461 0.322 0.700 0.400 CB 1.285 Z: 25 17.357 2.052 0.462 0.473 0.833 0.750 CA 1.457 25 residues pruned to eliminate duplicates Z: 14 6.669 1.690 0.801 0.263 0.769 0.615 CB 1.036 Z: 25 22.218 2.075 0.656 0.537 0.958 0.667 CB 1.328 25 residues pruned to eliminate duplicates Z: 7 5.794 1.745 1.082 0.697 0.667 0.333 CB 0.816 7 residues pruned to eliminate duplicates 6 1.681 1.491 0.572 0.290 0.400 0.400 N 1.015 ? Z: 46 32.969 2.288 0.644 0.458 0.822 0.533 CB 1.658 46 residues pruned to eliminate duplicates Z: 8 5.660 1.741 0.058 0.484 1.000 0.857 CB 1.180 Z: 7 7.155 1.891 0.801 0.573 0.833 0.667 CB 0.959 Z: 6 13.388 2.051 0.859 0.605 0.800 0.400 CB 1.776 Z: 11 18.581 2.071 0.586 0.850 1.000 0.600 CB 1.325 11 residues pruned to eliminate duplicates Z: 9 9.879 1.999 0.272 0.870 1.000 0.875 CA 1.003 9 residues pruned to eliminate duplicates Z: 35 28.811 2.226 0.678 0.575 0.882 0.676 CB 1.395 35 residues pruned to eliminate duplicates Z: 8 11.416 1.961 0.136 0.812 1.000 0.857 CA 1.477 8 residues pruned to eliminate duplicates Z: 7 22.346 2.195 1.307 0.729 1.000 0.500 CB 1.466 7 residues pruned to eliminate duplicates Z: 11 19.337 2.085 0.578 0.865 1.000 0.700 CB 1.362 11 residues pruned to eliminate duplicates Z: 15 7.838 2.038 0.416 0.328 0.643 0.429 CB 1.365 15 residues pruned to eliminate duplicates Z: 6 3.345 1.665 0.001 0.479 0.800 0.600 O 1.147 Z: 8 4.871 1.904 0.401 0.211 0.714 0.571 CB 1.360 Z: 81 52.389 2.494 0.654 0.491 0.887 0.625 CB 1.615 81 residues pruned to eliminate duplicates Z: 43 34.000 2.200 0.624 0.562 0.905 0.619 CB 1.528 43 residues pruned to eliminate duplicates Z: 18 12.679 2.307 0.434 0.328 0.824 0.706 CB 1.362 18 residues pruned to eliminate duplicates Z: 129 105.458 2.618 0.913 0.625 0.898 0.641 CA 1.842 129 residues pruned to eliminate duplicates Z: 9 4.044 1.609 0.526 0.415 0.750 0.500 CB 0.848 6 1.716 1.703 0.095 0.769 0.800 0.400 CB 0.405 ? Z: 16 41.300 2.841 0.984 0.637 0.933 0.333 CB 1.783 14 residues pruned to eliminate duplicates Z: 25 19.192 2.067 0.519 0.454 0.958 0.500 CB 1.366 25 residues pruned to eliminate duplicates Z: 16 4.760 1.827 0.445 0.241 0.667 0.333 CB 0.943 Z: 15 5.769 1.885 0.722 0.185 0.714 0.429 CA 0.971 Z: 16 12.312 2.093 0.610 0.250 0.867 0.467 CB 1.452 17 residues pruned to eliminate duplicates Z: 15 22.944 2.641 0.197 0.867 1.000 1.000 CA 1.419 15 residues pruned to eliminate duplicates Z: 7 9.137 2.213 0.426 0.698 0.833 0.833 CB 1.184 7 residues pruned to eliminate duplicates Z: 10 6.807 1.717 0.377 0.247 0.889 0.667 CA 1.445 Z: 13 3.085 1.874 -0.043 0.247 0.667 0.333 CB 0.996 Z: 8 14.270 2.124 0.506 0.818 0.857 0.714 CA 1.494 8 residues pruned to eliminate duplicates Z: 11 17.665 2.007 0.893 0.883 0.900 0.700 CB 1.181 11 residues pruned to eliminate duplicates Z: 68 86.686 2.608 1.126 0.661 0.940 0.701 CB 1.750 188 residues pruned to eliminate duplicates Z: 21 42.510 2.289 1.037 0.888 0.900 0.300 CB 1.631 21 residues pruned to eliminate duplicates Z: 7 4.926 1.608 0.592 0.413 0.833 0.667 CB 1.033 Z: 30 13.242 1.991 0.371 0.302 0.897 0.483 CB 1.253 31 residues pruned to eliminate duplicates Z: 74 83.525 2.627 1.008 0.606 0.877 0.644 CB 1.911 74 residues pruned to eliminate duplicates Z: 7 3.560 1.831 0.240 0.331 0.833 0.500 CB 0.924 Z: 133 112.193 2.641 0.952 0.629 0.894 0.682 CA 1.876 133 residues pruned to eliminate duplicates 6 1.125 1.431 0.272 0.287 0.600 0.200 C 0.585 ? Z: 12 19.318 2.163 0.578 0.880 0.818 0.818 CB 1.511 12 residues pruned to eliminate duplicates Z: 7 28.375 2.408 1.692 0.733 1.000 0.833 CA 1.449 7 residues pruned to eliminate duplicates Z: 7 3.194 1.557 0.827 0.116 0.667 0.333 O 1.116 Z: 15 16.682 2.287 0.789 0.374 0.857 0.500 CB 1.454 15 residues pruned to eliminate duplicates Z: 6 4.831 1.630 0.577 0.426 0.800 0.400 O 1.134 7 residues pruned to eliminate duplicates Z: 11 13.080 2.077 0.753 0.682 0.800 0.700 CB 1.201 Z: 10 7.329 1.936 0.589 0.534 1.000 0.778 CB 0.768 9 residues pruned to eliminate duplicates Z: 7 4.989 1.953 -0.158 0.646 0.833 0.833 CB 1.297 Z: 6 6.048 1.804 0.432 0.608 0.800 0.600 CA 1.182 Z: 19 19.468 2.107 1.095 0.550 0.722 0.389 CB 1.370 19 residues pruned to eliminate duplicates Z: 6 5.110 1.846 0.505 0.638 0.800 0.800 CB 0.903 Z: 18 24.881 2.208 0.519 0.590 1.000 0.824 CB 1.650 18 residues pruned to eliminate duplicates Z: 12 10.868 1.945 0.431 0.542 0.909 0.636 CB 1.243 23 residues pruned to eliminate duplicates Z: 6 3.179 1.636 0.485 0.437 0.800 0.400 CB 0.780 Z: 23 82.088 2.763 1.521 0.920 0.909 0.364 CA 1.947 23 residues pruned to eliminate duplicates Z: 13 9.546 1.904 0.748 0.505 0.750 0.500 CB 1.098 14 residues pruned to eliminate duplicates Z: 26 68.706 2.541 1.431 0.911 0.920 0.400 CA 1.713 26 residues pruned to eliminate duplicates Z: 7 3.156 1.560 0.650 0.233 0.667 0.500 CB 1.025 Z: 17 42.075 2.739 0.634 0.870 1.000 0.812 CA 1.716 17 residues pruned to eliminate duplicates Z: 21 23.233 2.204 0.612 0.497 1.000 0.750 CB 1.467 21 residues pruned to eliminate duplicates Z: 68 62.373 2.522 0.858 0.541 0.896 0.716 CB 1.745 68 residues pruned to eliminate duplicates Z: 9 4.634 1.705 1.130 0.327 0.500 0.250 N 1.092 Z: 13 21.164 2.182 0.569 0.879 0.833 0.750 CA 1.553 13 residues pruned to eliminate duplicates Z: 7 5.110 1.794 1.033 0.471 0.667 0.667 CB 0.883 Z: 9 12.578 2.026 0.292 0.802 1.000 0.625 CA 1.304 9 residues pruned to eliminate duplicates Z: 9 11.796 1.733 0.563 0.823 0.875 0.750 CB 1.330 9 residues pruned to eliminate duplicates Z: 6 4.662 1.812 0.355 0.486 0.800 0.400 CB 1.076 Z: 10 8.001 2.049 0.466 0.408 0.889 0.556 CB 1.100 10 residues pruned to eliminate duplicates Z: 7 4.868 1.919 0.598 0.249 0.667 0.333 C 1.298 Z: 18 16.352 2.259 0.311 0.411 0.882 0.588 CB 1.665 18 residues pruned to eliminate duplicates Z: 8 9.020 1.540 0.778 0.802 0.857 0.429 N 1.116 8 residues pruned to eliminate duplicates Z: 14 17.556 1.920 0.583 0.732 0.923 0.692 CB 1.409 14 residues pruned to eliminate duplicates Z: 16 13.700 2.227 0.492 0.254 0.933 0.467 CB 1.512 15 residues pruned to eliminate duplicates Z: 9 6.575 2.018 0.859 0.177 0.625 0.250 CB 1.465 Z: 7 6.443 1.610 1.240 0.647 0.833 0.500 CB 0.763 11 residues pruned to eliminate duplicates Z: 7 4.603 1.461 0.723 0.249 0.833 0.500 CB 1.195 Z: 45 35.212 2.397 0.576 0.514 0.886 0.523 CA 1.564 55 residues pruned to eliminate duplicates Z: 7 3.339 1.861 0.462 0.235 0.500 0.333 N 1.363 Z: 17 9.757 2.047 0.734 0.350 0.750 0.625 CB 1.078 17 residues pruned to eliminate duplicates Z: 26 71.704 2.602 1.295 0.910 1.000 0.600 CA 1.703 26 residues pruned to eliminate duplicates Z: 7 7.280 2.052 0.137 0.337 1.000 0.333 CB 1.523 Z: 8 12.843 1.970 0.311 0.792 1.000 0.714 CB 1.455 8 residues pruned to eliminate duplicates Z: 23 15.135 2.122 0.434 0.436 0.818 0.364 CB 1.385 23 residues pruned to eliminate duplicates Z: 9 4.352 1.610 0.459 0.281 0.750 0.375 CB 1.119 9 residues pruned to eliminate duplicates Z: 16 12.082 1.974 0.620 0.481 0.800 0.600 CB 1.243 8 residues pruned to eliminate duplicates Z: 7 4.619 2.191 -0.065 0.723 1.000 0.833 CB 0.753 7 residues pruned to eliminate duplicates Z: 112 67.174 2.363 0.767 0.500 0.937 0.640 CB 1.631 121 residues pruned to eliminate duplicates 7 1.305 1.451 0.705 0.083 0.333 0.333 CB 1.108 ? Z: 16 6.010 1.691 0.293 0.323 0.933 0.400 CB 0.924 Z: 7 2.893 1.589 0.382 0.479 0.500 0.333 CB 1.099 Z: 6 5.314 1.464 0.690 0.511 1.000 0.400 CB 0.950 Z: 53 26.907 2.192 0.595 0.375 0.846 0.577 CB 1.441 53 residues pruned to eliminate duplicates Z: 7 3.958 1.735 0.162 0.401 0.667 0.333 CA 1.335 7 residues pruned to eliminate duplicates Z: 7 3.629 1.791 -0.234 0.346 1.000 0.667 O 1.277 Z: 8 13.968 1.766 0.708 0.794 1.000 0.857 N 1.353 8 residues pruned to eliminate duplicates Z: 19 21.995 2.385 0.448 0.491 0.944 0.556 CB 1.605 19 residues pruned to eliminate duplicates Z: 12 24.913 2.017 0.856 0.844 0.909 0.455 CB 1.643 12 residues pruned to eliminate duplicates Z: 26 78.595 2.635 1.545 0.815 0.960 0.760 CB 1.856 Z: 33 23.702 1.967 0.536 0.553 0.875 0.594 CB 1.505 30 residues pruned to eliminate duplicates Z: 7 3.570 1.786 0.329 0.530 0.833 0.667 CB 0.716 Z: 12 11.142 2.158 0.617 0.389 0.818 0.636 CB 1.323 11 residues pruned to eliminate duplicates Z: 7 3.313 1.548 1.206 0.249 0.500 0.333 CB 1.058 Z: 6 3.429 1.488 0.483 0.496 0.800 0.400 C 0.872 Z: 10 27.011 2.525 0.953 0.433 1.000 0.778 CB 1.957 10 residues pruned to eliminate duplicates Z: 6 10.535 1.854 1.273 0.776 0.800 0.800 CB 1.095 5 residues pruned to eliminate duplicates Z: 7 8.419 1.829 0.177 0.894 1.000 1.000 CA 1.144 7 residues pruned to eliminate duplicates Z: 13 7.593 1.773 0.617 0.412 0.833 0.583 CB 1.006 7 residues pruned to eliminate duplicates Z: 6 7.976 2.095 0.674 0.527 0.800 0.600 CB 1.239 Z: 10 34.051 2.278 1.464 0.864 0.889 0.778 CA 1.668 10 residues pruned to eliminate duplicates Z: 7 2.607 1.605 0.169 0.307 0.667 0.333 CB 1.054 Z: 6 4.537 1.836 0.363 0.628 0.800 0.400 CB 0.898 Z: 8 12.746 1.894 1.171 0.730 0.857 0.429 N 1.111 Z: 6 8.021 1.641 1.073 0.836 0.800 0.600 N 0.987 Z: 16 20.646 2.272 0.634 0.557 0.933 0.733 CA 1.455 16 residues pruned to eliminate duplicates Z: 89 82.494 2.531 0.969 0.617 0.898 0.568 CB 1.760 89 residues pruned to eliminate duplicates Z: 6 2.536 1.773 -0.106 0.486 0.600 0.400 CB 1.210 6 residues pruned to eliminate duplicates 6 -0.168 1.330 0.494 0.448 1.000 0.200 CB-0.040 ? Z: 26 21.676 2.110 0.410 0.571 0.840 0.720 CB 1.620 26 residues pruned to eliminate duplicates Z: 12 6.339 1.902 0.241 0.479 0.909 0.455 CB 0.909 10 residues pruned to eliminate duplicates Z: 16 13.986 2.062 0.422 0.335 1.000 0.667 CB 1.474 16 residues pruned to eliminate duplicates Z: 20 38.362 2.450 0.957 0.746 0.947 0.842 CA 1.555 20 residues pruned to eliminate duplicates Z: 13 3.658 1.902 0.319 0.182 0.500 0.083 CB 1.234 13 residues pruned to eliminate duplicates Z: 6 7.185 2.011 0.451 0.696 1.000 0.800 CA 0.920 Z: 7 7.941 1.584 0.413 0.792 1.000 0.833 CB 1.121 Z: 15 32.066 2.159 1.021 0.786 1.000 0.786 CA 1.527 15 residues pruned to eliminate duplicates Z: 58 51.729 2.495 0.721 0.536 0.912 0.579 CB 1.689 58 residues pruned to eliminate duplicates Z: 10 3.366 1.776 0.652 0.163 0.556 0.222 N 1.038 Z: 9 10.923 2.040 0.422 0.759 0.875 0.625 N 1.209 9 residues pruned to eliminate duplicates Z: 9 13.993 2.007 0.683 0.663 1.000 0.750 CB 1.259 9 residues pruned to eliminate duplicates Z: 9 3.333 1.635 0.142 0.394 0.750 0.625 CB 0.941 9 residues pruned to eliminate duplicates Z: 21 50.895 2.639 1.084 0.774 0.950 0.800 CA 1.709 21 residues pruned to eliminate duplicates Z: 77 51.022 2.383 0.757 0.578 0.868 0.618 CB 1.493 77 residues pruned to eliminate duplicates Z: 13 5.192 2.019 0.779 0.386 0.917 0.500 CB 0.514 13 residues pruned to eliminate duplicates Z: 24 9.178 1.852 0.239 0.281 0.913 0.565 CB 1.170 25 residues pruned to eliminate duplicates Z: 6 2.485 1.575 0.674 0.337 0.400 0.400 C 1.258 Z: 9 6.249 1.639 0.364 0.434 0.875 0.500 CB 1.209 Z: 9 14.851 2.140 1.027 0.757 0.625 0.625 CA 1.540 9 residues pruned to eliminate duplicates Z: 19 21.169 2.027 0.710 0.579 0.944 0.667 CB 1.412 26 residues pruned to eliminate duplicates Z: 52 31.502 2.245 0.510 0.405 0.941 0.588 CB 1.528 53 residues pruned to eliminate duplicates Z: 20 32.951 2.228 0.520 0.922 1.000 1.000 CB 1.570 20 residues pruned to eliminate duplicates Z: 40 28.467 2.149 0.619 0.423 0.897 0.641 CB 1.581 40 residues pruned to eliminate duplicates Z: 8 6.114 2.133 0.159 0.556 0.714 0.571 CB 1.239 8 residues pruned to eliminate duplicates Z: 18 12.454 1.909 0.867 0.274 0.824 0.412 CB 1.330 19 residues pruned to eliminate duplicates Z: 41 39.518 2.447 0.861 0.465 0.950 0.650 CB 1.497 41 residues pruned to eliminate duplicates Z: 77 56.327 2.477 0.665 0.483 0.961 0.605 CB 1.659 77 residues pruned to eliminate duplicates Z: 7 2.307 1.545 0.039 0.234 0.667 0.167 CB 1.199 7 residues pruned to eliminate duplicates Z: 13 19.795 2.023 0.278 0.818 1.000 0.833 CA 1.676 13 residues pruned to eliminate duplicates Z: 21 22.139 2.015 0.724 0.833 0.850 0.700 CB 1.257 21 residues pruned to eliminate duplicates Z: 8 3.634 1.364 0.333 0.260 0.857 0.286 N 1.160 Z: 6 4.824 2.101 0.265 0.309 1.000 0.400 CB 1.004 6 residues pruned to eliminate duplicates Z: 77 34.340 2.221 0.594 0.370 0.895 0.539 CB 1.430 77 residues pruned to eliminate duplicates Z: 11 14.965 2.356 0.576 0.664 0.900 0.800 CA 1.217 12 residues pruned to eliminate duplicates Z: 15 43.829 2.761 1.433 0.851 1.000 0.857 CA 1.291 15 residues pruned to eliminate duplicates Z: 11 15.279 2.118 0.401 0.896 1.000 1.000 CB 1.166 11 residues pruned to eliminate duplicates Z: 19 69.825 2.702 1.318 0.909 0.944 0.611 CA 1.974 19 residues pruned to eliminate duplicates Z: 7 9.940 1.853 0.917 0.645 0.833 0.167 CB 1.197 7 residues pruned to eliminate duplicates Z: 51 62.732 2.660 0.859 0.575 0.940 0.600 CB 1.775 74 residues pruned to eliminate duplicates Z: 47 77.644 2.667 1.105 0.758 0.913 0.630 CB 1.775 47 residues pruned to eliminate duplicates 6 1.075 1.435 0.513 0.296 0.400 0.400 CB 0.695 ? Z: 24 19.457 2.166 0.568 0.467 0.913 0.652 CB 1.353 24 residues pruned to eliminate duplicates Z: 43 37.122 2.308 0.844 0.487 0.881 0.548 CB 1.547 43 residues pruned to eliminate duplicates Z: 6 4.171 1.695 0.700 0.438 0.600 0.400 CB 1.151 Z: 7 6.940 2.093 0.100 0.835 0.833 0.833 CA 1.106 7 residues pruned to eliminate duplicates Z: 8 3.277 1.659 0.370 0.373 0.571 0.429 CB 1.093 7 1.976 1.331 0.182 0.246 0.667 0.500 O 1.031 ? Z: 30 25.417 2.147 0.669 0.469 0.897 0.552 CB 1.516 30 residues pruned to eliminate duplicates Z: 90 60.759 2.422 0.726 0.497 0.910 0.663 CB 1.697 90 residues pruned to eliminate duplicates Z: 62 54.832 2.371 0.827 0.657 0.902 0.656 CB 1.553 58 residues pruned to eliminate duplicates Z: 64 58.030 2.534 0.768 0.568 0.905 0.683 CB 1.690 64 residues pruned to eliminate duplicates Z: 10 12.776 2.064 0.338 0.835 1.000 0.556 CB 1.155 10 residues pruned to eliminate duplicates 7 1.577 1.661 0.003 0.246 0.500 0.500 CB 1.037 ? Z: 7 3.568 1.335 0.285 0.516 0.833 0.500 C 1.003 Z: 68 43.156 2.340 0.677 0.451 0.910 0.582 CB 1.551 68 residues pruned to eliminate duplicates Z: 10 9.721 1.928 0.485 0.491 0.889 0.667 CB 1.285 10 residues pruned to eliminate duplicates Z: 9 8.559 2.284 0.774 0.387 1.000 0.625 CA 0.842 9 residues pruned to eliminate duplicates Z: 23 20.003 2.196 0.607 0.456 0.818 0.591 CB 1.544 23 residues pruned to eliminate duplicates 6 0.977 1.236 0.073 0.281 0.800 0.800 N 0.527 ? Z: 46 51.982 2.565 0.763 0.493 0.956 0.644 CA 1.806 46 residues pruned to eliminate duplicates Z: 42 33.196 2.229 0.610 0.527 0.878 0.561 CB 1.602 42 residues pruned to eliminate duplicates Z: 27 20.779 2.251 0.588 0.361 0.808 0.538 CB 1.639 27 residues pruned to eliminate duplicates Z: 6 4.837 2.017 0.241 0.257 0.800 0.400 CA 1.427 Z: 10 8.443 1.981 0.342 0.437 0.778 0.556 O 1.451 8 residues pruned to eliminate duplicates Z: 7 3.227 1.585 0.310 0.383 0.833 0.333 CB 0.862 Z: 24 31.492 2.194 0.890 0.761 0.870 0.652 CB 1.445 24 residues pruned to eliminate duplicates Z: 37 39.792 2.546 0.877 0.432 0.889 0.639 CB 1.676 37 residues pruned to eliminate duplicates Z: 14 26.510 2.647 0.665 0.427 1.000 0.538 CA 1.799 14 residues pruned to eliminate duplicates Z: 19 25.515 2.169 1.368 0.763 0.778 0.389 CB 1.192 19 residues pruned to eliminate duplicates Z: 62 83.460 2.784 1.036 0.609 0.885 0.590 CA 1.920 62 residues pruned to eliminate duplicates Z: 12 22.107 1.806 1.205 0.907 0.909 0.636 CB 1.308 12 residues pruned to eliminate duplicates Z: 6 5.652 1.729 0.355 0.484 0.800 0.600 CB 1.371 Z: 20 81.299 2.651 1.558 0.903 1.000 0.474 CA 1.960 20 residues pruned to eliminate duplicates Z: 24 25.725 2.025 0.586 0.802 0.957 0.522 CB 1.341 24 residues pruned to eliminate duplicates Z: 41 32.255 2.113 0.795 0.521 0.900 0.600 CB 1.464 41 residues pruned to eliminate duplicates Z: 66 54.350 2.343 0.985 0.604 0.831 0.569 CB 1.581 66 residues pruned to eliminate duplicates Z: 37 34.057 2.434 0.451 0.651 0.861 0.639 CB 1.620 37 residues pruned to eliminate duplicates Z: 63 33.763 2.246 0.549 0.446 0.887 0.694 CB 1.468 63 residues pruned to eliminate duplicates Z: 12 29.835 2.360 0.788 0.916 0.909 0.636 CA 1.655 12 residues pruned to eliminate duplicates Z: 18 8.131 1.999 0.567 0.152 0.706 0.588 CB 1.368 18 residues pruned to eliminate duplicates Z: 16 11.708 2.035 0.503 0.424 0.800 0.467 CB 1.338 16 residues pruned to eliminate duplicates Z: 6 3.118 1.257 0.467 0.711 1.000 0.800 CB 0.624 Z: 13 19.254 2.325 0.482 0.851 0.833 0.750 CB 1.434 13 residues pruned to eliminate duplicates Z: 37 34.901 2.630 0.365 0.508 0.972 0.694 CB 1.653 37 residues pruned to eliminate duplicates Z: 30 27.238 2.061 0.572 0.629 0.862 0.690 CB 1.604 33 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 21 13.397 2.019 0.379 0.342 0.850 0.650 CB 1.504 21 residues pruned to eliminate duplicates Z: 11 4.573 1.753 0.479 0.283 0.700 0.500 CB 1.018 Z: 6 2.655 1.773 0.452 0.117 0.600 0.400 O 1.246 6 residues pruned to eliminate duplicates Z: 18 9.494 1.859 0.272 0.390 1.000 0.647 CB 1.093 18 residues pruned to eliminate duplicates Z: 15 8.726 2.003 0.165 0.269 1.000 0.643 CB 1.301 15 residues pruned to eliminate duplicates Z: 15 10.644 2.048 0.221 0.367 1.000 0.357 CB 1.312 15 residues pruned to eliminate duplicates Z: 6 7.561 2.387 0.351 0.526 0.800 0.600 CA 1.277 Z: 22 50.091 2.791 0.641 0.833 1.000 0.810 CA 1.792 28 residues pruned to eliminate duplicates Z: 70 54.435 2.426 0.648 0.571 0.928 0.696 CB 1.649 70 residues pruned to eliminate duplicates Z: 24 58.066 2.736 0.991 0.734 0.913 0.870 CA 1.973 24 residues pruned to eliminate duplicates Z: 22 50.994 2.782 0.840 0.801 0.905 0.857 CA 1.847 22 residues pruned to eliminate duplicates Z: 22 65.891 2.838 1.159 0.805 0.905 0.762 CA 1.986 22 residues pruned to eliminate duplicates Z: 30 59.838 2.582 0.979 0.670 1.000 0.621 CB 1.858 30 residues pruned to eliminate duplicates Z: 24 50.079 2.660 1.011 0.724 0.913 0.565 CA 1.747 24 residues pruned to eliminate duplicates Z: 21 66.840 2.800 1.224 0.801 0.950 0.650 CA 1.942 21 residues pruned to eliminate duplicates Z: 23 72.666 2.756 1.299 0.769 0.955 0.545 CA 2.019 23 residues pruned to eliminate duplicates Z: 25 68.598 2.700 1.351 0.703 0.958 0.625 CB 1.913 25 residues pruned to eliminate duplicates Z: 23 68.526 2.779 1.259 0.770 0.909 0.500 CB 2.015 23 residues pruned to eliminate duplicates Z: 25 52.873 2.671 1.133 0.705 0.917 0.625 CB 1.715 25 residues pruned to eliminate duplicates Z: 23 71.458 2.758 1.403 0.735 0.955 0.545 CB 1.949 23 residues pruned to eliminate duplicates Z: 28 53.884 2.553 1.260 0.632 0.889 0.519 CB 1.785 28 residues pruned to eliminate duplicates Z: 26 51.418 2.563 1.234 0.669 0.840 0.360 CA 1.829 26 residues pruned to eliminate duplicates Z: 25 59.552 2.684 1.209 0.695 0.917 0.625 CB 1.871 25 residues pruned to eliminate duplicates Z: 28 53.576 2.606 1.238 0.641 0.852 0.481 CB 1.819 28 residues pruned to eliminate duplicates Z: 81 58.433 2.438 0.772 0.529 0.925 0.625 CB 1.589 81 residues pruned to eliminate duplicates Z: 98 55.991 2.381 0.809 0.446 0.897 0.536 CB 1.556 98 residues pruned to eliminate duplicates Z: 30 44.352 2.564 1.096 0.477 0.862 0.655 CA 1.821 30 residues pruned to eliminate duplicates Z: 24 31.073 2.426 1.138 0.467 0.783 0.435 CA 1.651 24 residues pruned to eliminate duplicates Z: 26 42.066 2.595 0.984 0.505 0.880 0.520 CB 1.847 26 residues pruned to eliminate duplicates Z: 29 39.385 2.548 0.883 0.479 0.893 0.571 CB 1.774 29 residues pruned to eliminate duplicates Z: 114 95.154 2.580 0.962 0.617 0.912 0.611 CB 1.737 114 residues pruned to eliminate duplicates Z: 61 63.757 2.583 0.850 0.606 0.883 0.683 CB 1.763 61 residues pruned to eliminate duplicates Z: 133 89.747 2.500 0.846 0.619 0.886 0.561 CB 1.708 133 residues pruned to eliminate duplicates Z: 103 89.476 2.621 0.795 0.617 0.941 0.657 CB 1.791 103 residues pruned to eliminate duplicates Z: 29 44.219 2.627 1.177 0.460 0.857 0.607 CB 1.777 29 residues pruned to eliminate duplicates Z: 41 37.796 2.497 0.982 0.410 0.800 0.550 CB 1.659 41 residues pruned to eliminate duplicates Z: 26 25.973 2.413 0.563 0.387 0.880 0.560 CA 1.764 26 residues pruned to eliminate duplicates Z: 69 55.702 2.500 0.792 0.517 0.824 0.588 CA 1.799 69 residues pruned to eliminate duplicates Z: 30 41.756 2.573 1.078 0.460 0.897 0.586 CB 1.686 30 residues pruned to eliminate duplicates Z: 133 97.916 2.554 0.803 0.636 0.917 0.598 CB 1.777 133 residues pruned to eliminate duplicates Z: 63 56.595 2.515 0.867 0.490 0.903 0.629 CB 1.712 63 residues pruned to eliminate duplicates Z: 103 58.475 2.429 0.712 0.496 0.853 0.667 CB 1.640 103 residues pruned to eliminate duplicates Z: 68 60.920 2.518 0.820 0.528 0.881 0.657 CB 1.794 68 residues pruned to eliminate duplicates Z: 30 39.682 2.553 0.952 0.476 0.862 0.586 CA 1.759 30 residues pruned to eliminate duplicates Z: 26 43.436 2.606 0.984 0.493 0.920 0.520 CA 1.839 26 residues pruned to eliminate duplicates Z: 109 56.583 2.432 0.599 0.477 0.907 0.639 CB 1.579 109 residues pruned to eliminate duplicates Z: 96 60.592 2.415 0.726 0.545 0.842 0.621 CB 1.694 96 residues pruned to eliminate duplicates Z: 64 65.011 2.561 0.873 0.564 0.937 0.619 CB 1.713 64 residues pruned to eliminate duplicates Z: 76 64.685 2.540 0.830 0.527 0.880 0.640 CB 1.778 76 residues pruned to eliminate duplicates Z: 104 73.213 2.548 0.777 0.563 0.893 0.583 CB 1.677 104 residues pruned to eliminate duplicates Z: 32 32.213 2.360 0.738 0.403 0.871 0.645 CB 1.794 32 residues pruned to eliminate duplicates Z: 86 60.710 2.460 0.727 0.558 0.906 0.706 CB 1.617 86 residues pruned to eliminate duplicates Z: 66 65.891 2.548 0.944 0.538 0.892 0.523 CA 1.781 66 residues pruned to eliminate duplicates Z: 62 57.981 2.541 0.824 0.510 0.918 0.607 CB 1.728 62 residues pruned to eliminate duplicates Z: 85 64.694 2.449 0.704 0.589 0.905 0.643 CA 1.717 85 residues pruned to eliminate duplicates Z: 46 45.479 2.502 0.814 0.516 0.844 0.578 CB 1.741 46 residues pruned to eliminate duplicates Z: 118 90.415 2.548 0.802 0.625 0.915 0.624 CB 1.769 118 residues pruned to eliminate duplicates Z: 94 65.950 2.465 0.747 0.568 0.903 0.677 CB 1.646 94 residues pruned to eliminate duplicates Z: 87 65.556 2.444 0.711 0.581 0.895 0.628 CB 1.747 87 residues pruned to eliminate duplicates Z: 34 46.557 2.523 0.704 0.678 0.879 0.697 CB 1.820 34 residues pruned to eliminate duplicates Z: 88 68.738 2.490 0.738 0.601 0.908 0.644 CB 1.704 88 residues pruned to eliminate duplicates Z: 103 62.357 2.448 0.748 0.513 0.882 0.627 CB 1.615 103 residues pruned to eliminate duplicates Z: 101 64.874 2.429 0.774 0.538 0.880 0.590 CB 1.648 101 residues pruned to eliminate duplicates Z: 102 61.828 2.452 0.654 0.518 0.901 0.644 CB 1.654 102 residues pruned to eliminate duplicates Z: 100 65.452 2.470 0.718 0.556 0.889 0.646 CB 1.651 100 residues pruned to eliminate duplicates Z: 87 66.802 2.489 0.762 0.581 0.872 0.663 CB 1.743 87 residues pruned to eliminate duplicates Z: 85 66.130 2.519 0.691 0.599 0.905 0.655 CB 1.705 85 residues pruned to eliminate duplicates Z: 151 90.142 2.481 0.768 0.571 0.907 0.620 CB 1.728 151 residues pruned to eliminate duplicates Z: 106 88.464 2.598 0.964 0.619 0.876 0.629 CB 1.725 106 residues pruned to eliminate duplicates Z: 75 63.743 2.521 0.813 0.532 0.892 0.662 CB 1.761 75 residues pruned to eliminate duplicates Z: 103 61.014 2.412 0.687 0.532 0.882 0.686 CB 1.630 103 residues pruned to eliminate duplicates Z: 77 48.850 2.329 0.622 0.572 0.882 0.671 CB 1.570 77 residues pruned to eliminate duplicates Z: 103 83.934 2.599 0.924 0.602 0.873 0.598 CB 1.729 103 residues pruned to eliminate duplicates Z: 65 60.717 2.535 0.789 0.543 0.938 0.578 CB 1.712 65 residues pruned to eliminate duplicates Z: 104 63.455 2.448 0.695 0.538 0.903 0.660 CB 1.608 104 residues pruned to eliminate duplicates Z: 136 94.218 2.539 0.837 0.585 0.926 0.622 CB 1.730 136 residues pruned to eliminate duplicates Z: 65 62.933 2.580 0.866 0.549 0.906 0.688 CB 1.719 65 residues pruned to eliminate duplicates Z: 87 62.946 2.439 0.737 0.584 0.895 0.605 CB 1.651 87 residues pruned to eliminate duplicates Z: 103 67.181 2.449 0.744 0.544 0.902 0.686 CB 1.654 106 residues pruned to eliminate duplicates Z: 6 7.478 1.935 0.521 0.481 1.000 0.600 CA 1.159 6 residues pruned to eliminate duplicates Z: 32 25.569 2.215 0.525 0.520 0.871 0.613 CB 1.530 32 residues pruned to eliminate duplicates Z: 32 26.014 2.201 0.616 0.508 0.839 0.677 CB 1.553 32 residues pruned to eliminate duplicates Z: 42 39.784 2.454 0.533 0.555 0.927 0.707 CB 1.689 42 residues pruned to eliminate duplicates Z: 131 89.510 2.536 0.845 0.613 0.885 0.615 CB 1.705 131 residues pruned to eliminate duplicates Z: 130 91.429 2.538 0.850 0.622 0.907 0.620 CB 1.685 130 residues pruned to eliminate duplicates Z: 86 68.634 2.493 0.726 0.578 0.918 0.671 CB 1.748 86 residues pruned to eliminate duplicates Z: 58 50.440 2.426 0.533 0.639 0.947 0.789 CB 1.664 58 residues pruned to eliminate duplicates Z: 85 65.992 2.502 0.688 0.589 0.917 0.643 CB 1.708 85 residues pruned to eliminate duplicates Z: 94 66.700 2.482 0.744 0.560 0.903 0.720 CB 1.669 94 residues pruned to eliminate duplicates Z: 75 49.387 2.355 0.616 0.571 0.905 0.649 CB 1.556 75 residues pruned to eliminate duplicates Z: 59 49.591 2.403 0.567 0.665 0.914 0.707 CB 1.624 59 residues pruned to eliminate duplicates Z: 88 66.944 2.508 0.774 0.581 0.874 0.678 CB 1.708 88 residues pruned to eliminate duplicates Z: 76 50.833 2.364 0.720 0.557 0.907 0.680 CB 1.507 76 residues pruned to eliminate duplicates Z: 88 79.465 2.490 0.999 0.588 0.920 0.598 CB 1.711 88 residues pruned to eliminate duplicates Z: 60 59.268 2.412 0.842 0.644 0.932 0.678 CB 1.629 60 residues pruned to eliminate duplicates Z: 66 49.334 2.324 0.776 0.560 0.892 0.538 CB 1.568 66 residues pruned to eliminate duplicates Z: 85 70.468 2.504 0.817 0.596 0.905 0.714 CB 1.705 85 residues pruned to eliminate duplicates Z: 30 33.054 2.185 0.944 0.617 0.862 0.586 CB 1.501 30 residues pruned to eliminate duplicates Z: 90 71.675 2.455 0.885 0.572 0.921 0.551 CB 1.663 90 residues pruned to eliminate duplicates Z: 104 65.522 2.421 0.823 0.514 0.913 0.602 CB 1.580 104 residues pruned to eliminate duplicates Z: 97 70.990 2.470 0.966 0.559 0.896 0.646 CB 1.573 97 residues pruned to eliminate duplicates Z: 31 26.750 2.040 0.899 0.569 0.900 0.467 CB 1.310 31 residues pruned to eliminate duplicates Z: 88 69.496 2.464 0.882 0.565 0.908 0.667 CB 1.662 88 residues pruned to eliminate duplicates Z: 98 67.984 2.449 0.787 0.541 0.907 0.608 CB 1.670 98 residues pruned to eliminate duplicates Z: 22 34.048 2.248 0.999 0.782 0.905 0.810 CB 1.425 22 residues pruned to eliminate duplicates Z: 26 36.665 2.678 0.528 0.701 0.920 0.760 CA 1.622 Z: 15 37.610 2.838 0.584 0.790 1.000 0.857 CA 1.734 15 residues pruned to eliminate duplicates Z: 21 39.789 2.869 0.440 0.799 1.000 1.000 CA 1.657 25 residues pruned to eliminate duplicates Z: 21 52.176 2.681 0.935 0.896 0.950 0.850 CA 1.695 20 residues pruned to eliminate duplicates Z: 20 47.844 2.763 0.583 0.904 1.000 0.842 CA 1.787 20 residues pruned to eliminate duplicates Z: 24 45.733 2.741 0.792 0.745 0.957 0.739 CA 1.631 24 residues pruned to eliminate duplicates Z: 53 69.960 2.697 0.807 0.615 0.942 0.712 CA 1.895 76 residues pruned to eliminate duplicates Z: 37 44.693 2.614 0.796 0.578 0.861 0.611 CB 1.710 Z: 20 59.343 2.786 0.938 0.914 1.000 0.842 CA 1.783 21 residues pruned to eliminate duplicates Z: 20 62.767 2.728 1.017 0.941 1.000 0.737 CA 1.815 20 residues pruned to eliminate duplicates Z: 20 60.062 2.767 0.929 0.926 1.000 0.684 CA 1.810 20 residues pruned to eliminate duplicates Z: 18 63.535 2.783 1.071 0.928 1.000 0.588 CA 1.873 18 residues pruned to eliminate duplicates Z: 65 74.191 2.678 0.854 0.602 0.922 0.703 CB 1.839 101 residues pruned to eliminate duplicates Z: 55 69.120 2.624 0.819 0.591 1.000 0.593 CB 1.807 55 residues pruned to eliminate duplicates Z: 25 60.340 2.702 1.117 0.769 0.958 0.667 CA 1.771 Z: 19 69.422 2.837 1.259 0.927 0.944 0.500 CA 1.894 25 residues pruned to eliminate duplicates Z: 20 67.828 2.775 1.276 0.918 0.947 0.737 CA 1.834 19 residues pruned to eliminate duplicates Z: 20 61.326 2.821 1.119 0.932 0.895 0.684 CA 1.837 20 residues pruned to eliminate duplicates Z: 54 69.763 2.650 0.845 0.622 0.962 0.642 CB 1.816 74 residues pruned to eliminate duplicates Z: 23 60.176 2.777 1.210 0.806 0.909 0.500 CA 1.760 Z: 8 6.213 1.732 0.981 0.428 0.571 0.286 CB 1.291 8 residues pruned to eliminate duplicates Z: 15 8.786 2.199 0.351 0.190 0.857 0.571 CB 1.336 15 residues pruned to eliminate duplicates Z: 8 10.717 2.215 0.639 0.361 0.857 0.571 CB 1.511 8 residues pruned to eliminate duplicates Z: 17 9.408 2.138 0.242 0.216 0.875 0.375 CB 1.415 17 residues pruned to eliminate duplicates Z: 16 8.059 2.047 0.334 0.202 0.800 0.267 CB 1.358 16 residues pruned to eliminate duplicates Z: 15 8.759 2.257 0.344 0.189 0.786 0.286 CB 1.427 15 residues pruned to eliminate duplicates Z: 18 8.747 2.115 0.059 0.210 0.941 0.529 CB 1.419 18 residues pruned to eliminate duplicates Z: 16 11.643 2.249 0.299 0.169 0.933 0.400 CB 1.648 16 residues pruned to eliminate duplicates Z: 16 12.386 2.269 0.355 0.190 0.933 0.400 CB 1.615 16 residues pruned to eliminate duplicates Z: 17 11.462 2.199 0.564 0.185 0.875 0.500 CB 1.390 17 residues pruned to eliminate duplicates Z: 16 8.074 2.273 0.213 0.151 0.800 0.467 CB 1.451 16 residues pruned to eliminate duplicates Z: 18 12.203 2.150 0.431 0.164 0.941 0.529 CB 1.539 18 residues pruned to eliminate duplicates Z: 16 8.495 2.172 0.396 0.191 0.800 0.467 CB 1.309 16 residues pruned to eliminate duplicates Z: 6 4.911 2.119 0.515 0.242 1.000 0.600 CB 0.922 6 residues pruned to eliminate duplicates Z: 70 55.827 2.491 0.727 0.509 0.884 0.565 CA 1.751 70 residues pruned to eliminate duplicates Z: 6 7.141 1.978 0.505 0.451 0.800 0.400 CB 1.410 6 residues pruned to eliminate duplicates Z: 6 4.789 1.723 0.291 0.577 0.800 0.600 CB 1.118 6 residues pruned to eliminate duplicates Z: 25 11.541 1.953 0.325 0.292 0.875 0.542 CB 1.313 26 residues pruned to eliminate duplicates Z: 7 5.303 1.594 0.548 0.461 0.833 0.500 N 1.095 Z: 6 7.081 1.966 0.769 0.333 0.800 0.000 N 1.366 6 residues pruned to eliminate duplicates Z: 18 13.010 2.140 0.441 0.417 0.882 0.471 CB 1.265 17 residues pruned to eliminate duplicates Z: 8 7.074 1.820 0.305 0.360 1.000 0.286 CB 1.308 8 residues pruned to eliminate duplicates Z: 23 12.858 1.964 0.454 0.353 0.818 0.500 CB 1.375 20 residues pruned to eliminate duplicates Z: 8 4.951 1.724 -0.111 0.440 0.857 0.429 O 1.513 8 residues pruned to eliminate duplicates Z: 23 13.998 2.076 0.415 0.325 0.909 0.455 CB 1.355 23 residues pruned to eliminate duplicates Z: 89 48.626 2.369 0.517 0.437 0.932 0.625 CB 1.653 89 residues pruned to eliminate duplicates Z: 22 16.060 2.130 0.356 0.411 0.952 0.619 CB 1.398 22 residues pruned to eliminate duplicates Z: 22 18.766 2.166 0.426 0.387 1.000 0.476 CB 1.495 17 residues pruned to eliminate duplicates Z: 22 16.467 2.165 0.201 0.407 1.000 0.381 CB 1.523 22 residues pruned to eliminate duplicates Z: 24 14.389 2.131 0.247 0.340 0.957 0.565 CB 1.405 24 residues pruned to eliminate duplicates Z: 25 15.798 1.997 0.507 0.348 0.958 0.625 CB 1.319 25 residues pruned to eliminate duplicates Z: 43 22.266 2.221 0.425 0.311 0.929 0.524 CB 1.442 43 residues pruned to eliminate duplicates Z: 69 34.022 2.218 0.498 0.399 0.912 0.412 CB 1.516 69 residues pruned to eliminate duplicates Z: 23 15.618 2.119 0.353 0.358 0.955 0.455 CB 1.419 23 residues pruned to eliminate duplicates Z: 99 56.178 2.432 0.613 0.422 0.939 0.592 CB 1.671 109 residues pruned to eliminate duplicates Z: 99 54.017 2.429 0.577 0.405 0.929 0.612 CB 1.695 99 residues pruned to eliminate duplicates Z: 53 32.354 2.273 0.527 0.379 0.923 0.577 CB 1.594 53 residues pruned to eliminate duplicates Z: 53 31.313 2.254 0.521 0.398 0.904 0.462 CB 1.560 53 residues pruned to eliminate duplicates Z: 54 32.608 2.240 0.478 0.402 0.925 0.491 CB 1.624 54 residues pruned to eliminate duplicates Z: 88 52.524 2.388 0.665 0.434 0.897 0.598 CB 1.690 88 residues pruned to eliminate duplicates Z: 52 33.898 2.274 0.538 0.387 0.941 0.647 CB 1.626 52 residues pruned to eliminate duplicates Z: 31 31.735 2.291 0.747 0.481 0.900 0.633 CB 1.639 31 residues pruned to eliminate duplicates Z: 84 57.911 2.437 0.724 0.458 0.916 0.627 CB 1.725 84 residues pruned to eliminate duplicates Z: 91 51.088 2.357 0.655 0.432 0.911 0.600 CB 1.627 91 residues pruned to eliminate duplicates Z: 103 60.340 2.411 0.675 0.463 0.922 0.588 CB 1.667 103 residues pruned to eliminate duplicates Z: 76 53.638 2.513 0.575 0.470 0.933 0.520 CB 1.729 76 residues pruned to eliminate duplicates Z: 81 48.008 2.410 0.582 0.460 0.887 0.550 CB 1.652 81 residues pruned to eliminate duplicates Z: 52 30.892 2.273 0.497 0.356 0.922 0.471 CB 1.611 52 residues pruned to eliminate duplicates Z: 73 64.370 2.548 0.738 0.511 0.931 0.542 CB 1.821 73 residues pruned to eliminate duplicates Z: 30 28.295 2.282 0.622 0.409 0.897 0.621 CA 1.742 30 residues pruned to eliminate duplicates Z: 24 30.128 2.408 0.681 0.372 0.957 0.609 CB 1.862 24 residues pruned to eliminate duplicates Z: 54 33.961 2.228 0.528 0.388 0.943 0.547 CB 1.637 54 residues pruned to eliminate duplicates Z: 54 27.256 2.213 0.483 0.327 0.906 0.377 CB 1.523 54 residues pruned to eliminate duplicates Z: 78 57.009 2.500 0.630 0.503 0.909 0.649 CB 1.748 78 residues pruned to eliminate duplicates Z: 79 53.038 2.464 0.687 0.520 0.833 0.654 CB 1.699 79 residues pruned to eliminate duplicates Z: 65 51.054 2.472 0.672 0.486 0.922 0.578 CB 1.698 65 residues pruned to eliminate duplicates Z: 71 49.772 2.401 0.598 0.493 0.929 0.629 CB 1.680 71 residues pruned to eliminate duplicates Z: 116 65.679 2.417 0.634 0.498 0.939 0.609 CB 1.655 115 residues pruned to eliminate duplicates Z: 7 10.010 1.623 0.804 0.497 1.000 0.500 N 1.400 7 residues pruned to eliminate duplicates Z: 81 58.914 2.459 0.709 0.497 0.900 0.637 CB 1.746 81 residues pruned to eliminate duplicates Z: 64 49.275 2.489 0.547 0.502 0.921 0.603 CB 1.748 64 residues pruned to eliminate duplicates Z: 63 52.103 2.477 0.544 0.521 0.968 0.597 CB 1.751 63 residues pruned to eliminate duplicates Z: 63 49.525 2.511 0.579 0.486 0.903 0.565 CB 1.781 63 residues pruned to eliminate duplicates Z: 65 48.140 2.481 0.643 0.482 0.875 0.609 CB 1.717 65 residues pruned to eliminate duplicates Z: 37 30.439 2.255 0.616 0.442 0.889 0.611 CB 1.662 37 residues pruned to eliminate duplicates Z: 78 55.601 2.488 0.637 0.499 0.896 0.675 CB 1.737 78 residues pruned to eliminate duplicates Z: 86 41.759 2.288 0.462 0.432 0.941 0.588 CB 1.544 86 residues pruned to eliminate duplicates Z: 92 60.921 2.497 0.577 0.514 0.912 0.637 CB 1.754 92 residues pruned to eliminate duplicates Z: 63 54.949 2.519 0.661 0.518 0.935 0.677 CB 1.751 63 residues pruned to eliminate duplicates Z: 63 50.227 2.485 0.522 0.517 0.935 0.677 CB 1.774 63 residues pruned to eliminate duplicates Z: 88 63.976 2.495 0.687 0.540 0.908 0.667 CA 1.726 88 residues pruned to eliminate duplicates Z: 78 61.817 2.516 0.689 0.590 0.896 0.662 CA 1.697 78 residues pruned to eliminate duplicates Z: 79 53.336 2.441 0.662 0.484 0.885 0.679 CB 1.710 79 residues pruned to eliminate duplicates Z: 86 67.838 2.535 0.703 0.509 0.941 0.718 CB 1.795 86 residues pruned to eliminate duplicates Z: 66 53.586 2.513 0.668 0.502 0.938 0.662 CB 1.687 66 residues pruned to eliminate duplicates Z: 65 49.467 2.481 0.616 0.485 0.922 0.625 CB 1.698 65 residues pruned to eliminate duplicates Z: 66 53.575 2.480 0.688 0.487 0.938 0.631 CB 1.714 66 residues pruned to eliminate duplicates Z: 75 54.863 2.456 0.656 0.495 0.946 0.608 CB 1.665 75 residues pruned to eliminate duplicates Z: 79 71.397 2.575 0.633 0.642 0.936 0.731 CA 1.799 79 residues pruned to eliminate duplicates Z: 99 52.142 2.362 0.542 0.451 0.949 0.561 CB 1.602 97 residues pruned to eliminate duplicates Z: 13 28.161 2.139 0.625 0.866 1.000 0.750 CB 1.712 13 residues pruned to eliminate duplicates Z: 74 49.918 2.370 0.759 0.477 0.890 0.603 CB 1.610 74 residues pruned to eliminate duplicates Z: 65 56.980 2.554 0.662 0.569 0.922 0.672 CA 1.703 65 residues pruned to eliminate duplicates Z: 76 52.492 2.481 0.655 0.493 0.893 0.573 CB 1.663 76 residues pruned to eliminate duplicates Z: 77 54.233 2.374 0.804 0.488 0.895 0.605 CB 1.644 77 residues pruned to eliminate duplicates Z: 64 51.190 2.513 0.670 0.504 0.889 0.635 CB 1.722 64 residues pruned to eliminate duplicates Z: 63 53.503 2.484 0.744 0.499 0.935 0.597 CB 1.678 63 residues pruned to eliminate duplicates Z: 68 52.722 2.412 0.711 0.479 0.925 0.657 CB 1.722 68 residues pruned to eliminate duplicates Z: 35 45.909 2.630 0.751 0.465 0.971 0.676 CB 1.826 35 residues pruned to eliminate duplicates Z: 65 57.004 2.579 0.721 0.508 0.938 0.562 CA 1.698 65 residues pruned to eliminate duplicates Z: 57 48.687 2.439 0.746 0.490 0.929 0.518 CB 1.663 57 residues pruned to eliminate duplicates Z: 64 48.523 2.438 0.698 0.440 0.905 0.619 CB 1.736 64 residues pruned to eliminate duplicates Z: 50 51.652 2.567 0.748 0.494 0.939 0.694 CB 1.763 50 residues pruned to eliminate duplicates Z: 63 48.464 2.480 0.693 0.436 0.919 0.565 CB 1.703 63 residues pruned to eliminate duplicates Z: 77 69.468 2.545 0.761 0.577 0.934 0.618 CA 1.766 77 residues pruned to eliminate duplicates Z: 60 47.290 2.480 0.693 0.456 0.915 0.559 CB 1.675 60 residues pruned to eliminate duplicates Z: 71 64.549 2.554 0.772 0.542 0.914 0.686 CA 1.790 71 residues pruned to eliminate duplicates Z: 79 61.460 2.479 0.812 0.501 0.923 0.628 CB 1.677 79 residues pruned to eliminate duplicates Z: 48 43.908 2.525 0.621 0.484 0.936 0.596 CB 1.699 48 residues pruned to eliminate duplicates Z: 90 56.620 2.439 0.676 0.506 0.865 0.596 CA 1.687 90 residues pruned to eliminate duplicates Z: 94 63.356 2.458 0.809 0.496 0.871 0.656 CB 1.704 94 residues pruned to eliminate duplicates Z: 73 55.956 2.524 0.703 0.519 0.903 0.569 CB 1.667 74 residues pruned to eliminate duplicates Z: 10 21.740 2.353 0.885 0.668 0.889 0.778 CA 1.574 10 residues pruned to eliminate duplicates Z: 51 47.990 2.497 0.747 0.531 0.940 0.580 CB 1.606 17 residues pruned to eliminate duplicates Z: 7 23.502 2.562 0.666 0.781 1.000 0.667 CA 1.755 7 residues pruned to eliminate duplicates Z: 62 49.952 2.463 0.764 0.425 0.918 0.574 CB 1.734 48 residues pruned to eliminate duplicates Z: 9 17.681 2.333 0.603 0.722 1.000 0.750 CA 1.368 9 residues pruned to eliminate duplicates Z: 74 62.719 2.540 0.647 0.604 0.918 0.685 CA 1.733 74 residues pruned to eliminate duplicates Z: 83 55.931 2.443 0.780 0.468 0.890 0.598 CB 1.648 83 residues pruned to eliminate duplicates Z: 6 14.547 2.540 0.787 0.484 0.800 0.600 CA 1.821 6 residues pruned to eliminate duplicates Z: 24 25.782 2.604 0.820 0.389 0.826 0.652 CB 1.543 24 residues pruned to eliminate duplicates Z: 76 56.073 2.469 0.823 0.472 0.893 0.587 CB 1.657 76 residues pruned to eliminate duplicates Z: 6 6.177 1.849 0.545 0.521 1.000 0.200 CA 0.947 6 residues pruned to eliminate duplicates Z: 76 54.378 2.487 0.765 0.465 0.920 0.547 CB 1.611 76 residues pruned to eliminate duplicates Z: 78 52.537 2.475 0.680 0.451 0.935 0.597 CB 1.620 78 residues pruned to eliminate duplicates Z: 79 55.876 2.507 0.635 0.465 0.923 0.551 CB 1.733 79 residues pruned to eliminate duplicates Z: 77 54.071 2.485 0.658 0.422 0.934 0.500 CB 1.746 77 residues pruned to eliminate duplicates Z: 64 50.951 2.521 0.720 0.492 0.905 0.667 CB 1.649 64 residues pruned to eliminate duplicates Z: 78 54.171 2.501 0.708 0.455 0.896 0.545 CB 1.690 78 residues pruned to eliminate duplicates Z: 17 20.354 2.425 0.980 0.365 0.750 0.438 CA 1.633 17 residues pruned to eliminate duplicates Z: 14 18.112 2.523 0.638 0.409 0.846 0.385 CB 1.581 14 residues pruned to eliminate duplicates Z: 67 41.967 2.385 0.637 0.482 0.848 0.606 CB 1.587 67 residues pruned to eliminate duplicates Z: 9 15.980 2.140 1.294 0.472 1.000 0.750 CB 1.184 9 residues pruned to eliminate duplicates Z: 65 65.319 2.597 0.776 0.565 0.938 0.688 CA 1.773 65 residues pruned to eliminate duplicates Z: 56 61.465 2.660 0.798 0.570 0.909 0.636 CA 1.782 56 residues pruned to eliminate duplicates Z: 25 41.126 2.623 0.656 0.718 1.000 0.833 CA 1.585 25 residues pruned to eliminate duplicates Z: 71 62.798 2.571 0.704 0.524 0.957 0.657 CA 1.748 71 residues pruned to eliminate duplicates Z: 74 67.005 2.550 0.837 0.521 0.890 0.575 CB 1.842 74 residues pruned to eliminate duplicates Z: 28 40.387 2.535 0.739 0.662 1.000 0.778 CA 1.516 28 residues pruned to eliminate duplicates Z: 21 45.026 2.542 1.076 0.750 0.950 0.850 CA 1.606 21 residues pruned to eliminate duplicates Z: 76 64.657 2.542 0.756 0.552 0.907 0.653 CA 1.754 76 residues pruned to eliminate duplicates Z: 70 74.918 2.565 0.889 0.579 0.942 0.623 CB 1.831 62 residues pruned to eliminate duplicates Z: 19 55.648 2.620 1.205 0.889 0.944 0.667 CA 1.730 19 residues pruned to eliminate duplicates Z: 116 62.745 2.367 0.805 0.440 0.878 0.513 CB 1.659 29 residues pruned to eliminate duplicates Z: 20 56.749 2.502 1.411 0.906 1.000 0.632 CA 1.535 20 residues pruned to eliminate duplicates Z: 69 66.129 2.540 0.942 0.551 0.912 0.603 CB 1.697 69 residues pruned to eliminate duplicates Z: 65 58.196 2.493 0.922 0.553 0.906 0.562 CB 1.591 65 residues pruned to eliminate duplicates Z: 43 42.334 2.327 0.965 0.539 0.857 0.476 CB 1.605 43 residues pruned to eliminate duplicates Z: 74 71.629 2.575 0.816 0.571 0.932 0.521 CB 1.798 74 residues pruned to eliminate duplicates Z: 97 73.582 2.519 0.772 0.549 0.917 0.656 CB 1.750 115 residues pruned to eliminate duplicates Z: 20 60.511 2.585 1.448 0.922 1.000 0.789 CA 1.543 20 residues pruned to eliminate duplicates Z: 76 68.552 2.513 0.897 0.588 0.907 0.613 CB 1.683 76 residues pruned to eliminate duplicates Z: 61 72.669 2.595 0.927 0.622 0.933 0.683 CB 1.791 61 residues pruned to eliminate duplicates Z: 96 78.113 2.531 0.816 0.541 0.947 0.600 CB 1.768 96 residues pruned to eliminate duplicates Z: 24 32.183 2.298 0.624 0.789 0.913 0.696 CB 1.528 24 residues pruned to eliminate duplicates Z: 32 31.914 2.322 0.556 0.631 0.935 0.645 CB 1.500 32 residues pruned to eliminate duplicates Z: 25 25.285 2.158 0.463 0.696 0.958 0.708 CB 1.426 25 residues pruned to eliminate duplicates Z: 43 24.876 2.141 0.378 0.530 0.881 0.643 CB 1.435 68 residues pruned to eliminate duplicates Z: 45 28.798 2.145 0.521 0.530 0.909 0.636 CB 1.420 45 residues pruned to eliminate duplicates Z: 19 33.178 2.322 0.690 0.827 0.944 0.833 CB 1.590 19 residues pruned to eliminate duplicates Z: 33 30.005 2.267 0.541 0.625 0.906 0.656 CB 1.490 33 residues pruned to eliminate duplicates Z: 27 32.785 2.185 0.728 0.730 0.962 0.654 CB 1.440 27 residues pruned to eliminate duplicates Z: 98 64.919 2.467 0.756 0.558 0.887 0.649 CB 1.622 119 residues pruned to eliminate duplicates Z: 28 29.797 2.169 0.760 0.689 0.852 0.556 CB 1.484 Z: 20 38.244 2.319 0.798 0.873 0.947 0.737 CB 1.617 28 residues pruned to eliminate duplicates Z: 22 35.125 2.115 0.860 0.889 0.952 0.810 CB 1.473 22 residues pruned to eliminate duplicates Z: 19 43.782 2.349 0.985 0.929 1.000 0.889 CB 1.548 20 residues pruned to eliminate duplicates Z: 22 41.509 2.178 0.996 0.867 1.000 0.619 CB 1.524 19 residues pruned to eliminate duplicates Z: 22 43.189 2.229 1.126 0.921 0.952 0.810 CB 1.470 21 residues pruned to eliminate duplicates Z: 19 48.828 2.389 1.161 0.905 1.000 0.833 CB 1.587 20 residues pruned to eliminate duplicates Z: 22 46.971 2.246 1.157 0.908 1.000 0.762 CB 1.503 23 residues pruned to eliminate duplicates Z: 24 51.991 2.823 0.616 0.902 0.957 0.783 CA 1.772 24 residues pruned to eliminate duplicates Z: 44 65.824 2.699 0.816 0.721 0.884 0.698 CA 1.897 44 residues pruned to eliminate duplicates Z: 127 85.708 2.530 0.684 0.622 0.873 0.714 CB 1.830 127 residues pruned to eliminate duplicates Z: 44 58.437 2.647 0.784 0.641 0.860 0.605 CB 1.922 44 residues pruned to eliminate duplicates Z: 89 66.431 2.434 0.780 0.591 0.886 0.659 CB 1.690 50 residues pruned to eliminate duplicates Z: 25 62.836 2.789 0.717 0.921 1.000 0.792 CA 1.886 25 residues pruned to eliminate duplicates Z: 48 62.834 2.586 0.787 0.706 0.915 0.574 CA 1.796 48 residues pruned to eliminate duplicates Z: 45 64.263 2.633 0.800 0.701 0.909 0.523 CB 1.873 45 residues pruned to eliminate duplicates Z: 109 87.785 2.608 0.788 0.605 0.889 0.639 CB 1.845 109 residues pruned to eliminate duplicates Z: 50 54.527 2.470 0.996 0.605 0.837 0.592 CB 1.709 50 residues pruned to eliminate duplicates Z: 57 73.086 2.694 0.922 0.657 0.893 0.518 CB 1.825 57 residues pruned to eliminate duplicates Z: 43 77.369 2.716 0.994 0.752 0.905 0.571 CB 1.945 43 residues pruned to eliminate duplicates Z: 44 77.625 2.646 1.071 0.731 0.953 0.628 CB 1.840 44 residues pruned to eliminate duplicates Z: 51 73.645 2.583 0.978 0.698 0.940 0.600 CA 1.811 51 residues pruned to eliminate duplicates Z: 35 84.112 2.790 1.199 0.724 0.971 0.706 CB 1.979 35 residues pruned to eliminate duplicates Z: 35 69.580 2.699 1.063 0.741 0.882 0.559 CA 1.957 35 residues pruned to eliminate duplicates Z: 27 69.548 2.739 1.249 0.754 0.962 0.769 CA 1.836 27 residues pruned to eliminate duplicates Z: 37 70.766 2.766 0.998 0.706 0.917 0.556 CA 1.931 37 residues pruned to eliminate duplicates Z: 113 84.870 2.540 0.868 0.595 0.875 0.598 CB 1.764 113 residues pruned to eliminate duplicates Z: 36 79.356 2.752 1.029 0.771 0.943 0.486 CB 2.004 36 residues pruned to eliminate duplicates Z: 45 62.855 2.631 0.864 0.726 0.864 0.591 CA 1.824 45 residues pruned to eliminate duplicates Z: 36 68.714 2.745 0.966 0.702 0.914 0.600 CA 1.958 36 residues pruned to eliminate duplicates Z: 43 88.016 2.741 1.063 0.751 0.976 0.738 CA 1.967 43 residues pruned to eliminate duplicates Z: 86 69.141 2.479 0.834 0.582 0.871 0.624 CB 1.751 89 residues pruned to eliminate duplicates Z: 6 2.800 1.647 0.755 0.238 0.600 0.200 CA 0.978 Z: 8 11.029 2.052 1.130 0.383 0.714 0.571 CA 1.513 8 residues pruned to eliminate duplicates Z: 43 82.231 2.669 1.161 0.768 0.952 0.571 CB 1.820 43 residues pruned to eliminate duplicates Z: 9 27.200 2.470 1.198 0.605 1.000 0.500 CB 1.603 15 residues pruned to eliminate duplicates Z: 9 24.708 2.526 0.976 0.604 1.000 0.750 CB 1.586 9 residues pruned to eliminate duplicates Z: 9 22.244 2.506 0.857 0.554 0.875 0.750 CA 1.832 9 residues pruned to eliminate duplicates Z: 47 72.651 2.563 1.021 0.723 0.935 0.674 CA 1.809 52 residues pruned to eliminate duplicates Z: 14 25.678 2.274 0.534 0.878 0.923 0.538 CB 1.605 14 residues pruned to eliminate duplicates Z: 37 69.408 2.714 0.875 0.814 0.972 0.833 CA 1.779 37 residues pruned to eliminate duplicates Z: 49 56.222 2.528 0.718 0.648 0.896 0.688 CB 1.816 49 residues pruned to eliminate duplicates Z: 25 21.868 2.425 0.388 0.547 0.875 0.708 CB 1.447 25 residues pruned to eliminate duplicates Z: 34 61.843 2.664 0.868 0.702 0.970 0.758 CB 1.856 34 residues pruned to eliminate duplicates Z: 35 64.992 2.663 1.012 0.708 0.941 0.794 CB 1.830 35 residues pruned to eliminate duplicates Z: 47 66.366 2.568 0.978 0.685 0.935 0.652 CB 1.739 47 residues pruned to eliminate duplicates Z: 34 61.991 2.669 0.820 0.699 0.970 0.758 CA 1.910 34 residues pruned to eliminate duplicates Z: 47 59.048 2.523 0.869 0.653 0.935 0.674 CA 1.713 47 residues pruned to eliminate duplicates Z: 70 80.869 2.554 1.130 0.651 0.899 0.551 CB 1.730 66 residues pruned to eliminate duplicates Z: 14 24.256 2.469 0.780 0.740 0.923 0.692 CB 1.337 14 residues pruned to eliminate duplicates Z: 46 63.382 2.561 0.905 0.715 0.911 0.667 CB 1.750 46 residues pruned to eliminate duplicates Z: 39 64.152 2.633 0.948 0.776 0.868 0.763 CA 1.832 39 residues pruned to eliminate duplicates Z: 37 71.515 2.672 1.029 0.783 0.917 0.667 CA 1.870 37 residues pruned to eliminate duplicates Z: 44 68.980 2.579 0.972 0.704 0.977 0.674 CB 1.759 44 residues pruned to eliminate duplicates Z: 140 93.592 2.499 0.856 0.626 0.921 0.604 CB 1.651 140 residues pruned to eliminate duplicates Z: 47 63.564 2.532 0.939 0.669 0.913 0.630 CB 1.789 47 residues pruned to eliminate duplicates Z: 48 65.102 2.576 0.792 0.713 0.979 0.702 CB 1.733 48 residues pruned to eliminate duplicates Z: 97 66.361 2.431 0.887 0.569 0.906 0.615 CB 1.525 97 residues pruned to eliminate duplicates Z: 32 69.104 2.680 1.228 0.703 1.000 0.677 CA 1.729 32 residues pruned to eliminate duplicates Z: 45 71.236 2.583 1.040 0.709 0.955 0.614 CB 1.766 45 residues pruned to eliminate duplicates Z: 48 55.267 2.443 0.977 0.600 0.915 0.638 CB 1.659 48 residues pruned to eliminate duplicates Z: 44 65.237 2.565 1.105 0.682 0.884 0.651 CB 1.764 44 residues pruned to eliminate duplicates Z: 41 65.096 2.543 0.930 0.740 0.950 0.550 CA 1.781 41 residues pruned to eliminate duplicates Z: 44 60.312 2.592 0.917 0.727 0.884 0.488 CB 1.707 44 residues pruned to eliminate duplicates Z: 38 66.205 2.623 1.117 0.712 0.892 0.649 CB 1.814 38 residues pruned to eliminate duplicates Z: 75 91.101 2.582 1.146 0.674 0.973 0.595 CB 1.673 75 residues pruned to eliminate duplicates Z: 41 67.912 2.583 1.016 0.729 0.975 0.375 CB 1.720 41 residues pruned to eliminate duplicates Z: 43 62.097 2.542 1.131 0.701 0.929 0.476 CB 1.585 43 residues pruned to eliminate duplicates Z: 33 67.909 2.696 1.254 0.758 0.906 0.375 CB 1.732 33 residues pruned to eliminate duplicates Z: 30 54.755 2.571 1.185 0.635 0.828 0.379 CB 1.928 30 residues pruned to eliminate duplicates Z: 64 87.490 2.680 0.957 0.736 0.921 0.603 CA 1.847 64 residues pruned to eliminate duplicates Z: 42 79.481 2.723 1.151 0.704 0.878 0.512 CB 2.005 42 residues pruned to eliminate duplicates Z: 93 74.208 2.554 0.887 0.592 0.870 0.522 CB 1.691 93 residues pruned to eliminate duplicates Z: 33 43.045 2.462 0.733 0.657 0.906 0.750 CA 1.701 33 residues pruned to eliminate duplicates Z: 87 83.387 2.622 0.842 0.628 0.907 0.674 CA 1.821 112 residues pruned to eliminate duplicates Z: 52 55.112 2.473 0.821 0.642 0.882 0.627 CB 1.700 13 residues pruned to eliminate duplicates Z: 28 47.110 2.541 0.747 0.803 0.963 0.704 CA 1.627 28 residues pruned to eliminate duplicates Z: 54 67.236 2.594 0.967 0.628 0.925 0.547 CB 1.735 54 residues pruned to eliminate duplicates Z: 91 93.252 2.643 0.920 0.601 0.944 0.644 CB 1.862 141 residues pruned to eliminate duplicates Z: 131 105.228 2.638 0.852 0.635 0.915 0.623 CB 1.818 131 residues pruned to eliminate duplicates Z: 24 33.064 2.299 0.958 0.598 0.870 0.652 CA 1.605 Z: 26 49.513 2.685 0.859 0.836 0.920 0.720 CA 1.614 24 residues pruned to eliminate duplicates Z: 25 62.837 2.648 1.167 0.841 0.875 0.625 CA 1.905 26 residues pruned to eliminate duplicates Z: 26 64.362 2.606 1.108 0.914 0.960 0.600 CA 1.726 25 residues pruned to eliminate duplicates Z: 22 56.789 2.623 1.229 0.833 0.905 0.524 CA 1.758 21 residues pruned to eliminate duplicates Z: 25 83.971 2.651 1.540 0.888 1.000 0.667 CA 1.833 27 residues pruned to eliminate duplicates Z: 24 80.807 2.658 1.508 0.885 0.913 0.304 CA 1.998 24 residues pruned to eliminate duplicates Z: 23 94.316 2.762 1.642 0.903 0.955 0.318 CB 2.059 25 residues pruned to eliminate duplicates Z: 14 47.604 2.690 1.300 0.861 0.923 0.538 CA 1.699 14 residues pruned to eliminate duplicates Z: 18 52.279 2.642 1.569 0.870 0.765 0.471 CA 1.783 17 residues pruned to eliminate duplicates Z: 24 88.792 2.737 1.631 0.891 0.957 0.435 CA 1.932 24 residues pruned to eliminate duplicates Z: 24 94.889 2.756 1.654 0.878 0.957 0.304 CA 2.052 24 residues pruned to eliminate duplicates Z: 21 53.053 2.512 1.670 0.646 0.900 0.200 CA 1.714 18 residues pruned to eliminate duplicates Z: 25 70.690 2.717 1.565 0.883 0.875 0.667 CA 1.711 25 residues pruned to eliminate duplicates Z: 79 102.052 2.711 1.227 0.661 0.897 0.551 CB 1.838 79 residues pruned to eliminate duplicates Z: 74 100.347 2.650 1.271 0.676 0.918 0.616 CB 1.809 74 residues pruned to eliminate duplicates Z: 125 106.303 2.621 1.045 0.611 0.871 0.581 CB 1.841 152 residues pruned to eliminate duplicates Z: 93 96.169 2.651 0.955 0.637 0.913 0.609 CB 1.863 93 residues pruned to eliminate duplicates Z: 71 93.666 2.618 1.100 0.696 0.971 0.514 CB 1.754 71 residues pruned to eliminate duplicates Z: 57 80.199 2.577 1.221 0.603 0.946 0.464 CB 1.793 57 residues pruned to eliminate duplicates Z: 46 85.513 2.730 1.324 0.635 0.933 0.600 CB 1.896 Z: 6 4.748 1.799 0.456 0.475 1.000 0.600 CA 0.832 6 residues pruned to eliminate duplicates Z: 142 105.475 2.633 0.971 0.539 0.922 0.518 CB 1.787 324 residues pruned to eliminate duplicates Z: 96 111.193 2.678 1.210 0.637 0.916 0.474 CB 1.851 96 residues pruned to eliminate duplicates Z: 129 118.766 2.642 1.057 0.653 0.922 0.578 CB 1.817 387 residues pruned to eliminate duplicates Z: 58 90.035 2.670 1.168 0.637 0.930 0.474 CB 1.949 58 residues pruned to eliminate duplicates Z: 82 97.190 2.648 1.100 0.638 0.901 0.420 CB 1.894 Z: 61 66.606 2.614 0.914 0.609 0.867 0.700 CB 1.790 143 residues pruned to eliminate duplicates Z: 26 41.249 2.615 1.107 0.453 0.840 0.600 CA 1.870 26 residues pruned to eliminate duplicates Z: 93 101.128 2.646 1.052 0.638 0.913 0.630 CB 1.870 93 residues pruned to eliminate duplicates Z: 94 94.916 2.634 0.960 0.627 0.925 0.677 CB 1.830 94 residues pruned to eliminate duplicates Z: 129 120.799 2.633 1.088 0.637 0.922 0.617 CB 1.853 129 residues pruned to eliminate duplicates Z: 65 59.405 2.567 0.696 0.574 0.922 0.547 CB 1.722 65 residues pruned to eliminate duplicates Z: 94 92.906 2.627 0.934 0.632 0.925 0.613 CB 1.812 94 residues pruned to eliminate duplicates Z: 67 55.607 2.532 0.871 0.530 0.848 0.591 CB 1.654 67 residues pruned to eliminate duplicates Z: 51 55.983 2.535 0.793 0.623 0.860 0.680 CB 1.804 51 residues pruned to eliminate duplicates Z: 61 65.875 2.594 0.898 0.604 0.883 0.600 CB 1.770 61 residues pruned to eliminate duplicates Z: 37 34.066 2.516 0.842 0.442 0.750 0.500 CB 1.735 37 residues pruned to eliminate duplicates Z: 21 33.516 2.571 0.911 0.470 0.850 0.550 CA 1.851 21 residues pruned to eliminate duplicates Z: 79 60.262 2.467 0.676 0.607 0.897 0.705 CB 1.661 79 residues pruned to eliminate duplicates Z: 27 47.469 2.689 1.004 0.540 0.885 0.577 CA 1.877 27 residues pruned to eliminate duplicates Z: 104 71.365 2.506 0.723 0.547 0.913 0.602 CB 1.704 105 residues pruned to eliminate duplicates Z: 53 54.961 2.535 0.737 0.616 0.904 0.654 CB 1.716 53 residues pruned to eliminate duplicates Z: 98 95.668 2.612 1.076 0.608 0.876 0.505 CB 1.845 98 residues pruned to eliminate duplicates Z: 29 38.600 2.636 0.970 0.434 0.786 0.571 CA 1.914 29 residues pruned to eliminate duplicates Z: 43 32.188 2.337 0.616 0.487 0.810 0.571 CB 1.646 43 residues pruned to eliminate duplicates Z: 46 51.703 2.536 0.720 0.597 0.956 0.667 CB 1.686 46 residues pruned to eliminate duplicates Z: 98 102.631 2.642 1.162 0.596 0.887 0.505 CB 1.878 98 residues pruned to eliminate duplicates Z: 49 50.672 2.515 0.812 0.558 0.917 0.750 CB 1.655 49 residues pruned to eliminate duplicates Z: 92 96.689 2.624 1.042 0.634 0.923 0.670 CB 1.807 92 residues pruned to eliminate duplicates Z: 22 28.919 2.381 0.717 0.455 0.905 0.667 CA 1.787 22 residues pruned to eliminate duplicates Z: 22 26.348 2.475 0.702 0.444 0.857 0.619 CA 1.687 22 residues pruned to eliminate duplicates Z: 61 61.679 2.599 0.803 0.581 0.900 0.650 CB 1.746 61 residues pruned to eliminate duplicates Z: 37 39.474 2.455 0.674 0.594 0.861 0.639 CB 1.699 37 residues pruned to eliminate duplicates Z: 61 68.080 2.616 0.851 0.590 0.917 0.667 CB 1.816 61 residues pruned to eliminate duplicates Z: 97 59.628 2.411 0.660 0.536 0.917 0.604 CB 1.602 95 residues pruned to eliminate duplicates Z: 25 43.774 2.321 0.603 0.796 1.000 0.625 CA 1.854 25 residues pruned to eliminate duplicates Z: 34 39.850 2.534 0.551 0.709 0.909 0.788 CB 1.606 34 residues pruned to eliminate duplicates Z: 61 69.845 2.621 0.751 0.617 0.933 0.700 CB 1.884 61 residues pruned to eliminate duplicates Z: 60 52.945 2.450 0.707 0.646 0.915 0.729 CB 1.571 60 residues pruned to eliminate duplicates Z: 38 36.511 2.447 0.534 0.635 0.892 0.730 CB 1.579 38 residues pruned to eliminate duplicates Z: 37 44.127 2.418 0.664 0.557 0.917 0.722 CB 1.887 37 residues pruned to eliminate duplicates Z: 81 49.369 2.369 0.659 0.511 0.875 0.663 CB 1.588 81 residues pruned to eliminate duplicates Z: 61 58.532 2.591 0.605 0.558 0.950 0.683 CB 1.808 61 residues pruned to eliminate duplicates Z: 62 60.699 2.580 0.723 0.549 0.918 0.639 CB 1.816 62 residues pruned to eliminate duplicates Z: 35 40.255 2.490 0.552 0.650 0.941 0.676 CB 1.651 35 residues pruned to eliminate duplicates Z: 53 55.950 2.544 0.741 0.593 0.923 0.750 CB 1.736 53 residues pruned to eliminate duplicates Z: 62 63.085 2.552 0.916 0.583 0.869 0.639 CB 1.756 62 residues pruned to eliminate duplicates Z: 35 43.413 2.533 0.566 0.686 0.941 0.676 CB 1.681 35 residues pruned to eliminate duplicates Z: 35 44.282 2.546 0.549 0.681 0.971 0.735 CB 1.680 35 residues pruned to eliminate duplicates Z: 97 93.304 2.597 1.080 0.616 0.896 0.542 CB 1.763 97 residues pruned to eliminate duplicates Z: 118 102.465 2.618 1.049 0.616 0.897 0.496 CB 1.763 118 residues pruned to eliminate duplicates Z: 41 37.329 2.426 0.754 0.594 0.850 0.525 CB 1.492 41 residues pruned to eliminate duplicates Z: 61 62.013 2.471 1.034 0.567 0.900 0.583 CB 1.659 61 residues pruned to eliminate duplicates Z: 35 43.226 2.525 0.833 0.657 0.882 0.706 CB 1.568 35 residues pruned to eliminate duplicates Z: 35 44.051 2.557 0.736 0.673 0.912 0.676 CB 1.592 35 residues pruned to eliminate duplicates Z: 100 93.552 2.609 1.049 0.605 0.899 0.576 CB 1.771 100 residues pruned to eliminate duplicates Z: 11 18.099 2.438 0.525 0.555 1.000 0.900 CB 1.459 11 residues pruned to eliminate duplicates Z: 50 51.889 2.492 0.786 0.563 0.918 0.673 CB 1.706 50 residues pruned to eliminate duplicates Z: 92 88.556 2.622 1.019 0.583 0.901 0.593 CB 1.797 92 residues pruned to eliminate duplicates Z: 38 42.202 2.493 0.760 0.612 0.919 0.676 CB 1.547 38 residues pruned to eliminate duplicates Z: 46 50.387 2.516 0.830 0.614 0.911 0.778 CB 1.607 46 residues pruned to eliminate duplicates Z: 171 109.175 2.530 0.991 0.603 0.918 0.571 CB 1.642 171 residues pruned to eliminate duplicates Z: 7 2.520 1.844 0.066 0.199 0.833 0.333 CA 0.899 7 residues pruned to eliminate duplicates Z: 172 108.138 2.568 0.932 0.591 0.895 0.573 CB 1.707 173 residues pruned to eliminate duplicates Z: 7 3.617 1.880 0.568 0.344 0.667 0.167 CB 0.890 7 residues pruned to eliminate duplicates Z: 89 72.020 2.511 0.842 0.587 0.898 0.659 CB 1.700 89 residues pruned to eliminate duplicates Z: 80 40.691 2.334 0.631 0.479 0.823 0.582 CB 1.493 80 residues pruned to eliminate duplicates Z: 194 118.233 2.563 0.966 0.577 0.896 0.534 CB 1.750 194 residues pruned to eliminate duplicates Z: 40 35.871 2.344 0.660 0.533 0.923 0.667 CB 1.548 40 residues pruned to eliminate duplicates Z: 21 36.077 2.195 0.769 0.863 0.950 0.750 CB 1.604 21 residues pruned to eliminate duplicates Z: 39 37.112 2.360 0.601 0.537 0.921 0.658 CB 1.668 40 residues pruned to eliminate duplicates Z: 95 63.035 2.461 0.756 0.562 0.894 0.628 CB 1.586 95 residues pruned to eliminate duplicates Z: 95 65.586 2.467 0.730 0.547 0.894 0.628 CB 1.694 95 residues pruned to eliminate duplicates Z: 26 34.748 2.307 1.050 0.700 0.920 0.640 CB 1.331 26 residues pruned to eliminate duplicates Z: 50 38.909 2.345 0.811 0.479 0.898 0.694 CB 1.489 50 residues pruned to eliminate duplicates Z: 40 38.092 2.320 0.879 0.549 0.923 0.590 CB 1.445 40 residues pruned to eliminate duplicates Z: 40 40.136 2.369 0.790 0.548 0.897 0.564 CB 1.612 40 residues pruned to eliminate duplicates Z: 76 54.867 2.360 0.866 0.528 0.907 0.427 CB 1.544 78 residues pruned to eliminate duplicates Z: 19 49.011 2.329 1.219 0.952 1.000 0.667 CB 1.539 19 residues pruned to eliminate duplicates Z: 30 34.594 2.297 0.997 0.606 0.966 0.448 CB 1.312 30 residues pruned to eliminate duplicates Z: 80 50.914 2.394 0.824 0.536 0.848 0.570 CB 1.494 80 residues pruned to eliminate duplicates Z: 79 53.298 2.391 0.893 0.577 0.821 0.551 CB 1.509 79 residues pruned to eliminate duplicates Z: 24 39.823 2.403 1.134 0.758 0.913 0.783 CB 1.410 24 residues pruned to eliminate duplicates Z: 40 35.934 2.318 0.825 0.561 0.897 0.564 CB 1.428 40 residues pruned to eliminate duplicates Z: 55 41.545 2.366 0.847 0.508 0.889 0.630 CB 1.444 55 residues pruned to eliminate duplicates Z: 54 39.121 2.254 0.902 0.508 0.830 0.566 CB 1.497 53 residues pruned to eliminate duplicates Z: 38 40.444 2.386 1.047 0.526 0.865 0.622 CB 1.534 38 residues pruned to eliminate duplicates Z: 28 37.909 2.288 1.120 0.662 0.889 0.741 CB 1.455 28 residues pruned to eliminate duplicates Z: 55 37.692 2.314 0.766 0.474 0.852 0.667 CB 1.513 55 residues pruned to eliminate duplicates Z: 41 41.725 2.356 0.881 0.566 0.900 0.575 CB 1.553 41 residues pruned to eliminate duplicates Z: 136 93.028 2.522 1.016 0.545 0.874 0.548 CB 1.724 136 residues pruned to eliminate duplicates Z: 41 41.352 2.360 0.953 0.569 0.875 0.575 CB 1.516 41 residues pruned to eliminate duplicates Z: 43 42.490 2.301 0.794 0.560 0.952 0.595 CB 1.574 38 residues pruned to eliminate duplicates Z: 6 5.517 1.817 1.185 0.540 0.600 0.600 N 0.996 6 residues pruned to eliminate duplicates Z: 40 43.390 2.407 0.861 0.569 0.923 0.641 CB 1.572 43 residues pruned to eliminate duplicates Z: 7 4.628 1.971 0.154 0.277 0.667 0.333 CB 1.603 7 residues pruned to eliminate duplicates Z: 42 45.188 2.382 0.856 0.563 0.951 0.585 CB 1.578 42 residues pruned to eliminate duplicates Z: 45 35.903 2.243 0.699 0.543 0.886 0.614 CB 1.535 45 residues pruned to eliminate duplicates Z: 136 92.354 2.512 0.934 0.582 0.896 0.548 CB 1.686 136 residues pruned to eliminate duplicates Z: 8 3.741 2.125 -0.002 0.451 0.714 0.429 CB 0.982 8 residues pruned to eliminate duplicates Z: 22 16.362 2.274 0.435 0.363 0.810 0.333 CB 1.565 22 residues pruned to eliminate duplicates Z: 99 61.566 2.434 0.754 0.549 0.878 0.643 CB 1.583 99 residues pruned to eliminate duplicates Z: 56 39.634 2.352 0.749 0.511 0.909 0.527 CB 1.414 56 residues pruned to eliminate duplicates Z: 135 99.661 2.551 0.957 0.577 0.933 0.619 CB 1.717 135 residues pruned to eliminate duplicates Z: 62 62.289 2.512 0.869 0.628 0.885 0.656 CA 1.701 71 residues pruned to eliminate duplicates Z: 63 64.342 2.474 0.830 0.594 0.952 0.710 CA 1.734 75 residues pruned to eliminate duplicates Z: 49 62.320 2.663 0.849 0.699 0.938 0.729 CA 1.625 49 residues pruned to eliminate duplicates Z: 45 65.677 2.668 1.031 0.694 0.909 0.659 CA 1.683 45 residues pruned to eliminate duplicates Z: 57 68.819 2.578 0.920 0.669 0.911 0.607 CA 1.746 57 residues pruned to eliminate duplicates Z: 44 63.462 2.642 0.893 0.731 0.953 0.744 CA 1.649 44 residues pruned to eliminate duplicates Z: 55 68.686 2.605 0.836 0.685 0.981 0.611 CA 1.681 55 residues pruned to eliminate duplicates Z: 61 61.682 2.538 0.864 0.631 0.883 0.550 CA 1.684 61 residues pruned to eliminate duplicates Z: 74 64.766 2.433 0.885 0.608 0.918 0.589 CA 1.625 82 residues pruned to eliminate duplicates Z: 50 72.978 2.655 1.022 0.698 0.959 0.714 CA 1.689 50 residues pruned to eliminate duplicates Z: 72 76.089 2.515 0.981 0.643 0.930 0.606 CA 1.707 76 residues pruned to eliminate duplicates Z: 17 23.734 2.236 0.907 0.747 0.875 0.688 CB 1.275 17 residues pruned to eliminate duplicates Z: 49 69.998 2.708 0.898 0.711 0.938 0.708 CA 1.731 49 residues pruned to eliminate duplicates Z: 56 84.624 2.594 1.136 0.681 0.982 0.618 CA 1.776 56 residues pruned to eliminate duplicates Z: 55 74.206 2.612 1.085 0.672 0.889 0.667 CA 1.780 55 residues pruned to eliminate duplicates Z: 46 62.281 2.587 1.037 0.647 0.867 0.489 CA 1.772 46 residues pruned to eliminate duplicates Z: 37 68.800 2.723 1.054 0.722 0.944 0.667 CA 1.776 37 residues pruned to eliminate duplicates Z: 49 83.502 2.699 1.193 0.714 0.938 0.688 CA 1.789 49 residues pruned to eliminate duplicates Z: 49 79.774 2.665 1.129 0.698 0.917 0.542 CB 1.849 49 residues pruned to eliminate duplicates Z: 38 63.015 2.619 1.164 0.737 0.919 0.595 CA 1.608 38 residues pruned to eliminate duplicates Z: 62 61.392 2.499 0.893 0.646 0.836 0.525 CB 1.735 62 residues pruned to eliminate duplicates Z: 73 72.091 2.507 0.924 0.654 0.917 0.569 CB 1.664 71 residues pruned to eliminate duplicates Z: 24 64.039 2.765 0.932 0.944 0.957 0.652 CA 1.809 24 residues pruned to eliminate duplicates Z: 49 64.260 2.584 0.939 0.675 0.896 0.521 CA 1.759 49 residues pruned to eliminate duplicates Z: 54 66.598 2.541 0.954 0.629 0.925 0.509 CA 1.764 54 residues pruned to eliminate duplicates Z: 48 80.774 2.664 1.130 0.716 0.936 0.511 CA 1.824 48 residues pruned to eliminate duplicates Z: 49 70.611 2.685 0.936 0.710 0.917 0.604 CA 1.767 49 residues pruned to eliminate duplicates Z: 22 54.685 2.696 1.079 0.684 0.952 0.667 CA 1.889 22 residues pruned to eliminate duplicates Z: 61 59.327 2.500 0.862 0.585 0.883 0.450 CB 1.717 61 residues pruned to eliminate duplicates Z: 45 70.516 2.569 1.097 0.639 0.955 0.500 CA 1.815 63 residues pruned to eliminate duplicates Z: 26 83.655 2.592 1.565 0.916 0.920 0.320 CA 1.932 26 residues pruned to eliminate duplicates Z: 52 73.054 2.575 1.134 0.688 0.941 0.412 CB 1.665 52 residues pruned to eliminate duplicates Z: 64 68.772 2.522 0.955 0.654 0.889 0.508 CB 1.713 52 residues pruned to eliminate duplicates Z: 24 52.652 2.580 1.342 0.877 0.870 0.261 CB 1.518 24 residues pruned to eliminate duplicates Z: 55 64.367 2.554 1.058 0.611 0.889 0.444 CB 1.687 55 residues pruned to eliminate duplicates Z: 25 82.489 2.731 1.357 0.914 0.958 0.667 CA 1.930 25 residues pruned to eliminate duplicates Z: 48 44.838 2.351 0.991 0.579 0.851 0.489 CB 1.522 45 residues pruned to eliminate duplicates Z: 24 37.016 2.401 1.082 0.693 0.783 0.174 CA 1.654 24 residues pruned to eliminate duplicates Z: 51 70.858 2.624 1.043 0.675 0.940 0.540 CB 1.692 51 residues pruned to eliminate duplicates Z: 49 77.251 2.647 1.176 0.689 0.938 0.479 CB 1.737 49 residues pruned to eliminate duplicates Z: 48 85.145 2.710 1.046 0.731 0.979 0.489 CA 1.859 48 residues pruned to eliminate duplicates Z: 27 52.857 2.562 1.183 0.665 0.885 0.462 CA 1.799 27 residues pruned to eliminate duplicates Z: 62 70.207 2.528 1.038 0.652 0.869 0.459 CB 1.743 62 residues pruned to eliminate duplicates Z: 52 68.292 2.535 1.227 0.618 0.902 0.510 CB 1.680 52 residues pruned to eliminate duplicates Z: 19 17.910 2.307 0.990 0.461 0.667 0.389 CB 1.435 19 residues pruned to eliminate duplicates Z: 44 63.616 2.569 1.240 0.661 0.884 0.372 CB 1.644 44 residues pruned to eliminate duplicates Z: 90 63.884 2.556 0.743 0.467 0.910 0.697 CB 1.728 Z: 7 8.559 1.716 1.228 0.329 1.000 0.500 CB 1.102 7 residues pruned to eliminate duplicates Z: 70 52.736 2.551 0.682 0.462 0.913 0.536 CB 1.685 70 residues pruned to eliminate duplicates Z: 75 56.994 2.622 0.648 0.473 0.932 0.635 CB 1.690 75 residues pruned to eliminate duplicates Z: 30 31.769 2.467 0.618 0.457 0.966 0.552 CB 1.600 30 residues pruned to eliminate duplicates Z: 98 67.845 2.642 0.627 0.525 0.907 0.649 CB 1.723 90 residues pruned to eliminate duplicates Z: 6 5.524 1.750 1.349 0.507 1.000 0.600 CB 0.597 6 residues pruned to eliminate duplicates Z: 45 31.064 2.444 0.479 0.442 0.909 0.636 CB 1.513 45 residues pruned to eliminate duplicates Z: 76 58.592 2.590 0.625 0.470 0.973 0.640 CB 1.702 76 residues pruned to eliminate duplicates Z: 7 9.131 2.247 0.332 0.446 1.000 0.667 CB 1.317 7 residues pruned to eliminate duplicates Z: 68 47.918 2.563 0.674 0.445 0.881 0.612 CB 1.640 68 residues pruned to eliminate duplicates Z: 64 49.148 2.578 0.583 0.468 0.937 0.683 CB 1.673 64 residues pruned to eliminate duplicates Z: 59 48.398 2.568 0.546 0.508 0.931 0.552 CB 1.706 59 residues pruned to eliminate duplicates Z: 43 35.739 2.486 0.579 0.500 0.905 0.667 CB 1.553 43 residues pruned to eliminate duplicates Z: 16 27.236 2.199 0.704 0.672 0.933 0.600 N 1.716 16 residues pruned to eliminate duplicates Z: 43 42.406 2.534 0.662 0.535 0.929 0.667 CB 1.616 43 residues pruned to eliminate duplicates Z: 13 23.888 2.216 0.645 0.896 0.917 0.833 CB 1.477 13 residues pruned to eliminate duplicates Z: 69 55.635 2.562 0.671 0.530 0.912 0.647 CB 1.679 69 residues pruned to eliminate duplicates Z: 29 34.791 2.481 0.775 0.511 0.929 0.571 CB 1.590 29 residues pruned to eliminate duplicates Z: 13 26.046 2.241 0.330 0.907 1.000 0.833 CB 1.793 13 residues pruned to eliminate duplicates Z: 65 53.058 2.595 0.645 0.493 0.938 0.656 CB 1.669 64 residues pruned to eliminate duplicates Z: 13 28.252 2.249 0.481 0.873 1.000 0.667 CB 1.782 13 residues pruned to eliminate duplicates Z: 82 55.685 2.442 0.725 0.491 0.889 0.580 CB 1.667 82 residues pruned to eliminate duplicates Z: 37 30.647 2.392 0.744 0.404 0.889 0.472 CB 1.524 38 residues pruned to eliminate duplicates Z: 13 31.629 2.215 0.769 0.877 1.000 0.667 CB 1.692 13 residues pruned to eliminate duplicates Z: 85 66.560 2.660 0.675 0.526 0.905 0.631 CB 1.755 85 residues pruned to eliminate duplicates Z: 31 36.116 2.503 0.821 0.487 0.900 0.633 CB 1.628 31 residues pruned to eliminate duplicates Z: 45 39.819 2.507 0.680 0.463 0.955 0.795 CB 1.552 45 residues pruned to eliminate duplicates Z: 66 48.982 2.561 0.712 0.465 0.892 0.677 CB 1.609 66 residues pruned to eliminate duplicates Z: 63 52.029 2.611 0.625 0.505 0.887 0.694 CB 1.747 63 residues pruned to eliminate duplicates Z: 33 36.110 2.450 0.557 0.620 0.969 0.781 CB 1.542 33 residues pruned to eliminate duplicates Z: 70 47.853 2.407 0.780 0.458 0.942 0.667 CB 1.490 43 residues pruned to eliminate duplicates Z: 7 10.772 1.916 1.233 0.191 1.000 0.333 CA 1.488 7 residues pruned to eliminate duplicates Z: 71 43.926 2.392 0.757 0.434 0.914 0.629 CB 1.463 70 residues pruned to eliminate duplicates Z: 7 7.005 2.126 0.136 0.431 1.000 0.667 CA 1.273 7 residues pruned to eliminate duplicates Z: 82 65.004 2.573 0.654 0.548 0.914 0.630 CB 1.774 82 residues pruned to eliminate duplicates Z: 87 71.605 2.657 0.747 0.534 0.895 0.674 CB 1.797 87 residues pruned to eliminate duplicates Z: 78 56.457 2.585 0.690 0.486 0.909 0.597 CB 1.643 78 residues pruned to eliminate duplicates Z: 45 39.444 2.497 0.689 0.485 0.909 0.682 CB 1.575 45 residues pruned to eliminate duplicates Z: 21 24.050 2.805 0.244 0.394 0.900 0.600 CB 1.914 21 residues pruned to eliminate duplicates Z: 33 39.963 2.723 0.623 0.471 0.906 0.625 CB 1.816 33 residues pruned to eliminate duplicates Z: 31 42.312 2.753 0.655 0.474 0.933 0.600 CB 1.865 31 residues pruned to eliminate duplicates Z: 76 54.715 2.622 0.599 0.484 0.907 0.613 CB 1.688 76 residues pruned to eliminate duplicates Z: 87 71.820 2.665 0.715 0.530 0.895 0.698 CB 1.837 87 residues pruned to eliminate duplicates Z: 44 52.884 2.757 0.685 0.584 0.837 0.651 CB 1.913 46 residues pruned to eliminate duplicates Z: 9 21.377 2.163 0.829 0.856 1.000 0.625 N 1.409 9 residues pruned to eliminate duplicates Z: 77 55.110 2.594 0.623 0.467 0.921 0.697 CB 1.685 77 residues pruned to eliminate duplicates Z: 68 50.121 2.410 0.641 0.465 0.940 0.567 CB 1.706 68 residues pruned to eliminate duplicates Z: 64 53.548 2.579 0.693 0.478 0.968 0.587 CB 1.632 64 residues pruned to eliminate duplicates Z: 43 39.903 2.559 0.588 0.537 0.810 0.524 CB 1.805 43 residues pruned to eliminate duplicates Z: 18 24.032 2.743 0.471 0.436 0.824 0.588 CA 1.874 18 residues pruned to eliminate duplicates Z: 68 57.555 2.608 0.753 0.463 0.940 0.582 CB 1.699 68 residues pruned to eliminate duplicates Z: 68 52.081 2.571 0.633 0.457 0.955 0.642 CB 1.657 68 residues pruned to eliminate duplicates Z: 95 52.286 2.482 0.670 0.432 0.894 0.564 CB 1.562 95 residues pruned to eliminate duplicates Z: 68 52.245 2.571 0.589 0.485 0.955 0.612 CB 1.662 68 residues pruned to eliminate duplicates Z: 65 56.968 2.664 0.645 0.528 0.922 0.703 CB 1.715 65 residues pruned to eliminate duplicates Z: 76 60.802 2.629 0.750 0.477 0.907 0.680 CB 1.723 76 residues pruned to eliminate duplicates Z: 96 68.642 2.600 0.688 0.499 0.895 0.632 CB 1.795 96 residues pruned to eliminate duplicates Z: 76 60.553 2.602 0.750 0.488 0.907 0.667 CB 1.714 76 residues pruned to eliminate duplicates Z: 76 56.713 2.621 0.630 0.470 0.920 0.667 CB 1.717 76 residues pruned to eliminate duplicates Z: 34 37.916 2.758 0.495 0.439 0.909 0.636 CB 1.874 34 residues pruned to eliminate duplicates Z: 98 75.543 2.615 0.774 0.524 0.887 0.711 CB 1.821 98 residues pruned to eliminate duplicates Z: 78 52.320 2.559 0.559 0.467 0.909 0.584 CB 1.701 78 residues pruned to eliminate duplicates Z: 33 33.125 2.627 0.551 0.499 0.906 0.625 CB 1.586 33 residues pruned to eliminate duplicates Z: 74 59.741 2.611 0.726 0.508 0.945 0.658 CB 1.628 74 residues pruned to eliminate duplicates Z: 75 57.244 2.611 0.666 0.493 0.905 0.649 CB 1.701 75 residues pruned to eliminate duplicates Z: 101 71.925 2.598 0.631 0.499 0.970 0.630 CB 1.752 101 residues pruned to eliminate duplicates Z: 30 49.921 2.639 0.814 0.636 0.966 0.724 CA 1.765 Z: 6 4.099 1.743 1.135 0.417 1.000 0.400 CA 0.537 6 residues pruned to eliminate duplicates Z: 100 68.466 2.582 0.734 0.495 0.909 0.636 CB 1.700 100 residues pruned to eliminate duplicates Z: 32 47.868 2.588 0.868 0.635 0.935 0.742 CA 1.675 31 residues pruned to eliminate duplicates Z: 6 12.692 2.153 0.987 0.479 0.800 0.600 CA 1.694 6 residues pruned to eliminate duplicates Z: 75 83.428 2.627 1.008 0.599 0.919 0.676 CA 1.820 106 residues pruned to eliminate duplicates Z: 30 41.213 2.424 0.713 0.644 0.966 0.724 CA 1.669 Z: 12 13.794 2.176 0.509 0.651 1.000 0.727 CB 1.100 12 residues pruned to eliminate duplicates Z: 48 58.564 2.723 0.675 0.712 0.915 0.745 CA 1.689 48 residues pruned to eliminate duplicates Z: 25 41.343 2.612 0.679 0.652 0.958 0.750 CB 1.742 25 residues pruned to eliminate duplicates Z: 64 63.625 2.587 0.781 0.612 0.857 0.667 CB 1.825 64 residues pruned to eliminate duplicates Z: 25 48.579 2.756 0.589 0.741 1.000 0.833 CA 1.825 25 residues pruned to eliminate duplicates Z: 93 77.724 2.543 0.681 0.617 0.913 0.696 CA 1.858 93 residues pruned to eliminate duplicates Z: 18 29.108 2.541 0.861 0.516 0.941 0.588 CA 1.562 18 residues pruned to eliminate duplicates Z: 30 50.583 2.721 0.799 0.735 0.966 0.828 CA 1.609 30 residues pruned to eliminate duplicates Z: 47 64.082 2.736 0.731 0.712 0.957 0.630 CA 1.721 47 residues pruned to eliminate duplicates Z: 27 54.694 2.820 0.758 0.759 0.962 0.846 CA 1.787 27 residues pruned to eliminate duplicates Z: 91 79.374 2.554 0.701 0.622 0.933 0.711 CA 1.838 91 residues pruned to eliminate duplicates Z: 23 49.959 2.766 0.895 0.705 1.000 0.727 CA 1.687 23 residues pruned to eliminate duplicates Z: 57 71.612 2.699 0.773 0.685 0.929 0.661 CA 1.817 57 residues pruned to eliminate duplicates Z: 74 76.960 2.618 0.873 0.603 0.918 0.699 CB 1.814 74 residues pruned to eliminate duplicates Z: 47 51.994 2.629 0.666 0.683 0.935 0.804 CA 1.584 47 residues pruned to eliminate duplicates Z: 56 75.684 2.678 0.919 0.679 0.909 0.618 CB 1.854 56 residues pruned to eliminate duplicates Z: 93 78.665 2.524 0.796 0.606 0.891 0.663 CB 1.836 93 residues pruned to eliminate duplicates Z: 47 73.644 2.722 0.858 0.718 0.935 0.761 CA 1.884 47 residues pruned to eliminate duplicates Z: 91 90.909 2.587 0.914 0.638 0.922 0.700 CB 1.845 91 residues pruned to eliminate duplicates Z: 94 85.204 2.540 0.868 0.619 0.914 0.667 CB 1.819 94 residues pruned to eliminate duplicates Z: 81 79.716 2.503 0.921 0.615 0.938 0.588 CB 1.774 81 residues pruned to eliminate duplicates Z: 48 74.026 2.671 1.075 0.694 0.894 0.574 CB 1.826 48 residues pruned to eliminate duplicates Z: 74 81.027 2.626 1.032 0.620 0.890 0.603 CB 1.783 74 residues pruned to eliminate duplicates Z: 132 87.850 2.416 0.903 0.599 0.901 0.603 CB 1.687 132 residues pruned to eliminate duplicates Z: 93 86.717 2.535 0.930 0.624 0.913 0.620 CB 1.799 93 residues pruned to eliminate duplicates Z: 38 67.810 2.718 1.052 0.687 0.946 0.703 CA 1.780 38 residues pruned to eliminate duplicates Z: 37 75.333 2.749 1.113 0.721 0.972 0.806 CA 1.821 37 residues pruned to eliminate duplicates Z: 67 76.869 2.623 1.049 0.607 0.864 0.621 CB 1.842 67 residues pruned to eliminate duplicates Z: 54 74.966 2.678 1.057 0.633 0.887 0.642 CB 1.861 54 residues pruned to eliminate duplicates Z: 40 98.786 2.777 1.360 0.754 0.974 0.667 CA 1.975 40 residues pruned to eliminate duplicates Z: 74 79.467 2.589 1.089 0.610 0.932 0.562 CB 1.663 74 residues pruned to eliminate duplicates Z: 57 67.069 2.514 1.107 0.603 0.911 0.589 CB 1.684 57 residues pruned to eliminate duplicates Z: 92 84.676 2.554 0.938 0.627 0.879 0.582 CB 1.810 92 residues pruned to eliminate duplicates Z: 81 78.539 2.547 0.869 0.610 0.925 0.588 CB 1.797 81 residues pruned to eliminate duplicates Z: 79 82.200 2.561 1.049 0.616 0.897 0.628 CB 1.771 79 residues pruned to eliminate duplicates Z: 124 84.790 2.463 0.843 0.589 0.911 0.634 CB 1.699 124 residues pruned to eliminate duplicates Z: 56 90.113 2.709 1.186 0.697 0.927 0.618 CB 1.849 56 residues pruned to eliminate duplicates Z: 114 88.698 2.577 0.975 0.544 0.929 0.619 CB 1.690 114 residues pruned to eliminate duplicates Z: 119 83.341 2.469 0.861 0.596 0.890 0.661 CB 1.712 119 residues pruned to eliminate duplicates Z: 75 76.053 2.616 1.068 0.619 0.892 0.595 CB 1.638 75 residues pruned to eliminate duplicates Z: 13 15.414 2.459 0.541 0.427 0.833 0.583 CB 1.520 13 residues pruned to eliminate duplicates Z: 81 81.352 2.540 1.028 0.622 0.913 0.663 CB 1.725 81 residues pruned to eliminate duplicates Z: 82 75.458 2.532 1.103 0.605 0.852 0.494 CB 1.673 82 residues pruned to eliminate duplicates Z: 64 80.273 2.638 1.051 0.653 0.905 0.619 CB 1.791 64 residues pruned to eliminate duplicates Z: 81 78.898 2.550 0.941 0.620 0.900 0.538 CB 1.768 81 residues pruned to eliminate duplicates Z: 74 79.873 2.625 1.134 0.610 0.918 0.575 CB 1.638 74 residues pruned to eliminate duplicates Z: 82 80.886 2.522 0.957 0.616 0.926 0.568 CB 1.763 82 residues pruned to eliminate duplicates Z: 68 72.664 2.592 1.051 0.580 0.896 0.612 CB 1.726 68 residues pruned to eliminate duplicates Z: 63 86.928 2.652 1.120 0.650 0.919 0.548 CB 1.856 63 residues pruned to eliminate duplicates Z: 11 20.214 2.493 0.875 0.513 0.900 0.400 CB 1.499 11 residues pruned to eliminate duplicates Z: 137 80.716 2.407 0.859 0.564 0.890 0.544 CB 1.634 137 residues pruned to eliminate duplicates Z: 29 32.770 2.402 0.774 0.496 0.929 0.607 CB 1.572 29 residues pruned to eliminate duplicates Z: 47 46.502 2.319 0.806 0.554 0.913 0.696 CB 1.702 47 residues pruned to eliminate duplicates Z: 47 42.776 2.331 0.875 0.540 0.848 0.587 CB 1.638 47 residues pruned to eliminate duplicates Z: 33 23.942 2.201 0.848 0.413 0.844 0.469 CB 1.350 33 residues pruned to eliminate duplicates Z: 116 67.677 2.360 0.889 0.519 0.852 0.504 CB 1.631 116 residues pruned to eliminate duplicates Z: 60 39.631 2.209 0.666 0.477 0.898 0.627 CB 1.597 60 residues pruned to eliminate duplicates Z: 90 85.095 2.523 0.953 0.613 0.910 0.573 CB 1.807 90 residues pruned to eliminate duplicates Z: 74 76.653 2.634 0.916 0.629 0.904 0.562 CB 1.742 74 residues pruned to eliminate duplicates Z: 92 93.898 2.561 1.057 0.645 0.890 0.571 CB 1.834 92 residues pruned to eliminate duplicates Z: 74 82.606 2.639 1.072 0.624 0.890 0.644 CB 1.766 74 residues pruned to eliminate duplicates Z: 73 41.653 2.201 0.677 0.481 0.847 0.556 CB 1.600 73 residues pruned to eliminate duplicates Z: 90 84.784 2.512 1.004 0.602 0.910 0.584 CB 1.780 90 residues pruned to eliminate duplicates Z: 64 81.724 2.649 1.127 0.611 0.905 0.524 CB 1.817 64 residues pruned to eliminate duplicates Z: 29 31.916 2.408 0.844 0.484 0.893 0.607 CB 1.546 29 residues pruned to eliminate duplicates Z: 46 50.346 2.371 0.862 0.547 0.956 0.600 CB 1.700 46 residues pruned to eliminate duplicates Z: 81 85.697 2.525 1.052 0.615 0.950 0.550 CB 1.746 81 residues pruned to eliminate duplicates Z: 128 79.960 2.411 0.964 0.591 0.882 0.567 CB 1.558 128 residues pruned to eliminate duplicates Z: 74 87.118 2.619 1.088 0.605 0.945 0.589 CB 1.786 74 residues pruned to eliminate duplicates Z: 80 76.173 2.557 1.038 0.587 0.886 0.582 CB 1.708 80 residues pruned to eliminate duplicates Z: 46 44.680 2.342 0.797 0.526 0.911 0.600 CB 1.693 46 residues pruned to eliminate duplicates Z: 127 84.110 2.446 0.917 0.574 0.897 0.563 CB 1.658 127 residues pruned to eliminate duplicates Z: 120 76.391 2.418 0.884 0.571 0.891 0.563 CB 1.611 120 residues pruned to eliminate duplicates Z: 40 32.449 2.201 0.572 0.492 0.949 0.641 CB 1.596 40 residues pruned to eliminate duplicates Z: 92 89.373 2.513 1.047 0.595 0.934 0.527 CB 1.782 92 residues pruned to eliminate duplicates Z: 100 85.984 2.464 0.953 0.613 0.919 0.646 CB 1.755 100 residues pruned to eliminate duplicates Z: 53 36.977 2.272 0.680 0.473 0.904 0.692 CB 1.528 53 residues pruned to eliminate duplicates Z: 107 83.606 2.430 1.034 0.575 0.925 0.660 CB 1.653 107 residues pruned to eliminate duplicates Z: 128 77.090 2.378 0.910 0.562 0.874 0.583 CB 1.622 128 residues pruned to eliminate duplicates Z: 91 83.571 2.551 0.978 0.617 0.911 0.578 CB 1.716 91 residues pruned to eliminate duplicates Z: 82 84.020 2.548 0.995 0.600 0.938 0.580 CB 1.779 82 residues pruned to eliminate duplicates Z: 120 78.584 2.424 0.831 0.582 0.891 0.647 CB 1.685 120 residues pruned to eliminate duplicates Z: 113 79.451 2.455 0.875 0.572 0.920 0.589 CB 1.655 113 residues pruned to eliminate duplicates Z: 84 43.681 2.227 0.714 0.492 0.831 0.530 CB 1.522 84 residues pruned to eliminate duplicates Z: 51 40.948 2.286 0.808 0.549 0.880 0.600 CB 1.518 51 residues pruned to eliminate duplicates Z: 85 51.710 2.291 0.671 0.536 0.893 0.595 CB 1.594 85 residues pruned to eliminate duplicates Z: 21 30.774 2.154 0.664 0.745 0.950 0.650 CB 1.623 21 residues pruned to eliminate duplicates Z: 129 76.573 2.404 0.837 0.564 0.883 0.633 CB 1.632 129 residues pruned to eliminate duplicates Z: 103 74.006 2.477 0.888 0.540 0.902 0.578 CB 1.671 103 residues pruned to eliminate duplicates Z: 114 74.560 2.459 0.859 0.560 0.876 0.619 CB 1.651 114 residues pruned to eliminate duplicates Z: 54 29.757 2.085 0.631 0.507 0.830 0.509 CB 1.438 54 residues pruned to eliminate duplicates Z: 69 41.964 2.329 0.720 0.433 0.912 0.559 CB 1.493 69 residues pruned to eliminate duplicates Z: 76 45.197 2.267 0.690 0.494 0.893 0.613 CB 1.534 76 residues pruned to eliminate duplicates Z: 84 49.109 2.266 0.698 0.530 0.892 0.627 CB 1.525 84 residues pruned to eliminate duplicates Z: 47 30.895 2.139 0.643 0.486 0.913 0.587 CB 1.440 47 residues pruned to eliminate duplicates Z: 27 17.069 2.075 0.533 0.364 0.808 0.423 CB 1.508 27 residues pruned to eliminate duplicates Z: 51 38.298 2.153 0.700 0.570 0.880 0.600 CB 1.571 51 residues pruned to eliminate duplicates Z: 84 50.883 2.276 0.687 0.560 0.880 0.627 CB 1.561 84 residues pruned to eliminate duplicates Z: 82 46.713 2.301 0.660 0.508 0.877 0.593 CB 1.539 82 residues pruned to eliminate duplicates Z: 57 40.392 2.170 0.636 0.594 0.893 0.679 CB 1.555 57 residues pruned to eliminate duplicates Z: 120 82.614 2.428 0.911 0.592 0.908 0.597 CB 1.647 120 residues pruned to eliminate duplicates Z: 29 22.907 2.154 0.472 0.454 0.929 0.536 CB 1.541 29 residues pruned to eliminate duplicates Z: 70 43.837 2.311 0.697 0.480 0.884 0.580 CB 1.553 70 residues pruned to eliminate duplicates Z: 57 38.599 2.145 0.655 0.599 0.875 0.661 CB 1.511 57 residues pruned to eliminate duplicates Z: 43 30.645 2.073 0.667 0.493 0.881 0.571 CB 1.565 43 residues pruned to eliminate duplicates Z: 68 42.765 2.302 0.779 0.463 0.866 0.537 CB 1.531 68 residues pruned to eliminate duplicates Z: 34 30.644 2.163 0.567 0.589 0.879 0.636 CB 1.644 34 residues pruned to eliminate duplicates Z: 43 31.148 2.159 0.608 0.551 0.857 0.667 CB 1.538 43 residues pruned to eliminate duplicates Z: 81 48.028 2.273 0.747 0.521 0.863 0.637 CB 1.537 81 residues pruned to eliminate duplicates Z: 26 16.774 2.129 0.632 0.328 0.800 0.480 CB 1.457 26 residues pruned to eliminate duplicates Z: 54 36.452 2.169 0.610 0.535 0.906 0.604 CB 1.530 54 residues pruned to eliminate duplicates Z: 37 31.776 2.241 0.760 0.506 0.861 0.611 CB 1.549 37 residues pruned to eliminate duplicates Z: 53 37.692 2.191 0.638 0.549 0.885 0.635 CB 1.570 53 residues pruned to eliminate duplicates Z: 43 33.335 2.147 0.651 0.552 0.952 0.571 CB 1.449 43 residues pruned to eliminate duplicates Z: 23 19.691 2.043 1.014 0.574 0.773 0.500 CB 1.229 23 residues pruned to eliminate duplicates Z: 18 23.294 2.181 1.176 0.707 0.765 0.706 CB 1.290 18 residues pruned to eliminate duplicates Z: 14 30.280 2.252 1.127 0.838 0.846 0.769 CB 1.548 14 residues pruned to eliminate duplicates Z: 128 77.673 2.404 0.857 0.577 0.906 0.646 CB 1.583 128 residues pruned to eliminate duplicates Z: 18 29.305 2.157 1.179 0.693 0.882 0.765 CB 1.436 18 residues pruned to eliminate duplicates Z: 18 25.053 2.148 1.001 0.691 0.882 0.588 CB 1.345 18 residues pruned to eliminate duplicates Z: 19 22.392 2.091 1.003 0.616 0.833 0.611 CB 1.356 19 residues pruned to eliminate duplicates Z: 19 26.152 2.160 0.958 0.633 0.889 0.611 CB 1.448 19 residues pruned to eliminate duplicates Z: 20 22.232 2.008 1.247 0.562 0.737 0.474 CB 1.445 20 residues pruned to eliminate duplicates Z: 16 23.297 2.118 0.702 0.758 0.933 0.800 CB 1.422 16 residues pruned to eliminate duplicates Z: 27 19.378 2.163 0.570 0.443 0.885 0.538 CB 1.341 27 residues pruned to eliminate duplicates Z: 26 23.997 2.183 0.741 0.399 1.000 0.680 CB 1.405 26 residues pruned to eliminate duplicates Z: 26 20.330 2.229 0.537 0.423 0.920 0.680 CB 1.398 26 residues pruned to eliminate duplicates Z: 26 19.715 2.231 0.607 0.417 0.880 0.640 CB 1.363 26 residues pruned to eliminate duplicates Z: 27 19.843 2.198 0.447 0.422 0.962 0.692 CB 1.380 27 residues pruned to eliminate duplicates Z: 24 23.819 2.246 0.652 0.436 0.957 0.696 CB 1.495 24 residues pruned to eliminate duplicates Z: 25 26.426 2.242 0.817 0.429 1.000 0.708 CB 1.426 25 residues pruned to eliminate duplicates Z: 25 25.233 2.255 0.672 0.436 0.958 0.667 CB 1.522 25 residues pruned to eliminate duplicates Z: 26 22.739 2.231 0.644 0.426 0.920 0.680 CB 1.456 26 residues pruned to eliminate duplicates Z: 26 23.191 2.217 0.673 0.448 0.960 0.560 CB 1.374 26 residues pruned to eliminate duplicates Z: 7 3.019 1.531 0.852 0.226 0.833 0.667 CA 0.718 7 residues pruned to eliminate duplicates Z: 25 21.509 2.136 0.605 0.360 0.958 0.542 CB 1.555 25 residues pruned to eliminate duplicates Z: 65 33.894 2.187 0.798 0.388 0.875 0.547 CB 1.387 65 residues pruned to eliminate duplicates Z: 24 22.562 2.270 0.666 0.377 0.957 0.696 CB 1.484 24 residues pruned to eliminate duplicates Z: 26 20.572 2.230 0.475 0.383 0.960 0.520 CB 1.476 26 residues pruned to eliminate duplicates Z: 26 20.815 2.240 0.603 0.325 0.960 0.520 CB 1.464 26 residues pruned to eliminate duplicates Z: 25 20.168 2.230 0.647 0.300 0.917 0.500 CB 1.528 25 residues pruned to eliminate duplicates Z: 27 20.043 2.188 0.752 0.342 0.923 0.577 CB 1.319 27 residues pruned to eliminate duplicates Z: 24 22.999 2.275 0.858 0.352 0.957 0.522 CB 1.392 24 residues pruned to eliminate duplicates Z: 204 111.504 2.497 0.956 0.578 0.897 0.527 CB 1.658 257 residues pruned to eliminate duplicates Z: 15 17.835 2.042 0.651 0.659 0.857 0.500 CB 1.423 15 residues pruned to eliminate duplicates Z: 48 52.412 2.595 0.669 0.527 0.936 0.660 CB 1.835 48 residues pruned to eliminate duplicates Z: 88 46.069 2.363 0.607 0.417 0.874 0.598 CB 1.624 88 residues pruned to eliminate duplicates Z: 68 32.664 2.258 0.543 0.386 0.866 0.463 CB 1.493 68 residues pruned to eliminate duplicates Z: 88 47.235 2.363 0.656 0.400 0.874 0.517 CB 1.646 88 residues pruned to eliminate duplicates Z: 48 60.464 2.675 0.800 0.501 0.957 0.660 CA 1.913 48 residues pruned to eliminate duplicates Z: 87 45.347 2.356 0.544 0.411 0.895 0.535 CB 1.647 87 residues pruned to eliminate duplicates Z: 57 45.243 2.375 0.633 0.509 0.929 0.625 CA 1.664 57 residues pruned to eliminate duplicates Z: 50 50.225 2.541 0.676 0.475 0.939 0.571 CA 1.842 50 residues pruned to eliminate duplicates Z: 102 57.751 2.401 0.733 0.449 0.891 0.574 CB 1.633 102 residues pruned to eliminate duplicates Z: 69 59.743 2.468 0.727 0.521 0.926 0.618 CB 1.797 69 residues pruned to eliminate duplicates Z: 49 55.825 2.594 0.967 0.462 0.917 0.646 CB 1.791 49 residues pruned to eliminate duplicates Z: 46 57.394 2.662 0.769 0.525 0.956 0.644 CB 1.855 46 residues pruned to eliminate duplicates Z: 85 49.065 2.395 0.628 0.400 0.917 0.524 CB 1.664 85 residues pruned to eliminate duplicates Z: 62 58.400 2.542 0.842 0.498 0.885 0.705 CB 1.807 62 residues pruned to eliminate duplicates Z: 48 56.274 2.679 0.780 0.468 0.936 0.702 CB 1.898 48 residues pruned to eliminate duplicates Z: 62 63.449 2.641 0.788 0.555 0.934 0.705 CA 1.746 76 residues pruned to eliminate duplicates Z: 121 69.696 2.474 0.596 0.499 0.917 0.617 CB 1.760 127 residues pruned to eliminate duplicates Z: 59 49.893 2.504 0.763 0.399 0.914 0.603 CA 1.808 59 residues pruned to eliminate duplicates Z: 65 50.642 2.455 0.771 0.444 0.875 0.594 CB 1.763 65 residues pruned to eliminate duplicates Z: 26 32.656 2.551 0.684 0.439 0.920 0.640 CA 1.760 26 residues pruned to eliminate duplicates Z: 61 51.529 2.500 0.729 0.454 0.933 0.583 CB 1.729 61 residues pruned to eliminate duplicates Z: 33 31.513 2.565 0.755 0.379 0.875 0.625 CA 1.610 33 residues pruned to eliminate duplicates Z: 47 50.970 2.631 0.758 0.518 0.891 0.717 CB 1.791 47 residues pruned to eliminate duplicates Z: 49 51.177 2.626 0.801 0.484 0.917 0.708 CB 1.731 49 residues pruned to eliminate duplicates Z: 50 47.104 2.544 0.709 0.451 0.898 0.551 CB 1.812 50 residues pruned to eliminate duplicates Z: 52 58.909 2.578 0.847 0.498 0.941 0.588 CB 1.845 52 residues pruned to eliminate duplicates Z: 49 51.877 2.651 0.723 0.469 0.938 0.646 CB 1.804 49 residues pruned to eliminate duplicates Z: 42 51.244 2.635 0.891 0.456 0.902 0.634 CB 1.862 42 residues pruned to eliminate duplicates Z: 99 56.901 2.428 0.688 0.437 0.898 0.531 CB 1.667 98 residues pruned to eliminate duplicates Z: 6 6.015 2.139 0.124 0.622 1.000 0.600 CA 0.997 6 residues pruned to eliminate duplicates Z: 76 61.449 2.547 0.722 0.454 0.933 0.627 CB 1.816 76 residues pruned to eliminate duplicates Z: 56 49.803 2.694 0.604 0.501 0.855 0.673 CA 1.817 56 residues pruned to eliminate duplicates Z: 17 18.772 2.593 0.565 0.441 0.812 0.375 CB 1.513 17 residues pruned to eliminate duplicates Z: 60 65.450 2.693 0.862 0.565 0.864 0.593 CA 1.846 60 residues pruned to eliminate duplicates Z: 79 57.395 2.525 0.745 0.468 0.897 0.564 CB 1.697 79 residues pruned to eliminate duplicates Z: 49 49.652 2.645 0.746 0.452 0.875 0.542 CA 1.863 49 residues pruned to eliminate duplicates Z: 101 60.312 2.423 0.681 0.426 0.930 0.600 CB 1.719 101 residues pruned to eliminate duplicates Z: 19 23.170 2.477 0.677 0.389 0.889 0.556 CB 1.665 19 residues pruned to eliminate duplicates Z: 118 79.635 2.475 0.738 0.483 0.949 0.598 CB 1.835 121 residues pruned to eliminate duplicates Z: 7 14.794 2.274 0.949 0.477 0.833 0.833 CA 1.673 Z: 6 11.523 2.051 0.932 0.341 1.000 0.600 N 1.546 6 residues pruned to eliminate duplicates Z: 18 41.489 2.633 0.612 0.874 0.941 0.882 CA 1.834 18 residues pruned to eliminate duplicates Z: 20 39.837 2.524 0.471 0.885 1.000 0.579 CA 1.777 19 residues pruned to eliminate duplicates Z: 20 37.662 2.422 0.543 0.877 1.000 0.579 CA 1.679 20 residues pruned to eliminate duplicates Z: 25 44.006 2.435 0.864 0.696 0.917 0.583 CA 1.806 25 residues pruned to eliminate duplicates Z: 19 41.074 2.590 0.489 0.902 1.000 0.611 CA 1.791 19 residues pruned to eliminate duplicates Z: 33 41.338 2.332 0.875 0.567 0.906 0.531 CB 1.729 23 residues pruned to eliminate duplicates Z: 20 50.116 2.543 0.934 0.897 0.947 0.789 CA 1.767 28 residues pruned to eliminate duplicates Z: 19 54.596 2.507 1.069 0.883 0.944 0.444 CA 1.900 20 residues pruned to eliminate duplicates Z: 21 34.878 2.395 0.685 0.884 0.750 0.500 CA 1.862 21 residues pruned to eliminate duplicates Z: 46 37.744 2.430 0.757 0.512 0.844 0.400 CB 1.543 46 residues pruned to eliminate duplicates Z: 22 55.010 2.527 1.195 0.797 0.905 0.476 CB 1.844 22 residues pruned to eliminate duplicates Z: 21 53.673 2.499 1.336 0.813 0.900 0.450 CB 1.740 21 residues pruned to eliminate duplicates Z: 62 41.916 2.354 0.813 0.478 0.852 0.475 CB 1.509 37 residues pruned to eliminate duplicates Z: 20 60.525 2.520 1.239 0.894 0.947 0.368 CA 1.864 20 residues pruned to eliminate duplicates Z: 64 49.925 2.375 0.816 0.534 0.905 0.524 CB 1.560 64 residues pruned to eliminate duplicates Z: 25 46.329 2.467 1.129 0.723 0.875 0.375 CB 1.683 25 residues pruned to eliminate duplicates Z: 23 47.923 2.470 1.017 0.740 0.955 0.500 CB 1.733 23 residues pruned to eliminate duplicates Z: 27 28.528 2.320 0.464 0.483 0.885 0.615 CB 1.893 27 residues pruned to eliminate duplicates Z: 54 35.768 2.235 0.585 0.448 0.906 0.528 CB 1.616 54 residues pruned to eliminate duplicates Z: 30 29.390 2.319 0.623 0.442 0.897 0.448 CB 1.716 30 residues pruned to eliminate duplicates Z: 53 30.967 2.244 0.576 0.384 0.885 0.558 CB 1.552 53 residues pruned to eliminate duplicates Z: 29 27.797 2.283 0.772 0.494 0.821 0.536 CB 1.590 29 residues pruned to eliminate duplicates Z: 55 36.427 2.240 0.676 0.425 0.926 0.593 CB 1.543 55 residues pruned to eliminate duplicates Z: 20 18.477 2.195 0.595 0.355 0.947 0.579 CB 1.494 20 residues pruned to eliminate duplicates Z: 18 14.649 2.177 0.501 0.314 1.000 0.588 CB 1.337 18 residues pruned to eliminate duplicates Z: 18 16.642 2.259 0.517 0.294 1.000 0.588 CB 1.483 18 residues pruned to eliminate duplicates Z: 16 18.452 2.195 0.752 0.364 0.933 0.400 CB 1.537 16 residues pruned to eliminate duplicates Z: 22 15.621 2.134 0.507 0.370 0.952 0.571 CB 1.279 22 residues pruned to eliminate duplicates Z: 20 16.973 2.201 0.558 0.289 1.000 0.579 CB 1.440 20 residues pruned to eliminate duplicates Z: 17 12.905 2.133 0.527 0.313 0.875 0.562 CB 1.393 17 residues pruned to eliminate duplicates Z: 13 15.909 2.260 0.649 0.401 0.917 0.417 CB 1.492 13 residues pruned to eliminate duplicates Z: 19 12.495 2.102 0.433 0.288 0.889 0.611 CB 1.396 19 residues pruned to eliminate duplicates Z: 39 19.494 2.214 0.418 0.257 0.868 0.579 CB 1.532 39 residues pruned to eliminate duplicates Z: 19 12.851 2.157 0.460 0.298 0.889 0.500 CB 1.357 19 residues pruned to eliminate duplicates Z: 16 15.149 2.074 0.641 0.313 0.933 0.533 CB 1.515 16 residues pruned to eliminate duplicates Z: 14 18.693 2.323 0.698 0.350 1.000 0.692 CB 1.547 14 residues pruned to eliminate duplicates Z: 20 12.589 2.102 0.429 0.304 0.895 0.474 CB 1.336 20 residues pruned to eliminate duplicates Z: 25 14.101 2.037 0.493 0.313 0.917 0.500 CB 1.269 25 residues pruned to eliminate duplicates Z: 9 2.507 1.413 -0.058 0.488 0.875 0.500 CB 0.770 Z: 6 4.303 1.881 0.685 0.285 0.600 0.200 CB 1.289 Z: 6 8.042 1.940 0.426 0.453 1.000 0.800 CA 1.364 4 residues pruned to eliminate duplicates Z: 9 4.420 1.716 0.224 0.328 0.750 0.500 CB 1.198 3 residues pruned to eliminate duplicates Z: 23 31.291 2.109 0.510 0.831 1.000 0.909 CA 1.575 9 residues pruned to eliminate duplicates Z: 20 33.440 2.228 0.572 0.812 1.000 0.842 CB 1.670 22 residues pruned to eliminate duplicates Z: 19 24.249 2.091 0.578 0.882 0.833 0.611 CA 1.504 19 residues pruned to eliminate duplicates Z: 27 28.357 2.232 0.474 0.683 0.885 0.654 CB 1.616 27 residues pruned to eliminate duplicates Z: 27 30.320 2.214 0.580 0.680 0.923 0.654 CB 1.559 27 residues pruned to eliminate duplicates Z: 27 31.513 2.193 0.637 0.695 0.885 0.808 CB 1.629 27 residues pruned to eliminate duplicates Z: 28 29.102 2.166 0.569 0.643 0.889 0.593 CB 1.621 26 residues pruned to eliminate duplicates Z: 20 31.761 2.154 0.553 0.874 1.000 0.737 CA 1.586 21 residues pruned to eliminate duplicates Z: 19 28.274 2.205 0.508 0.824 0.889 0.667 CA 1.703 19 residues pruned to eliminate duplicates Z: 19 22.762 2.146 0.194 0.846 0.889 0.722 CB 1.750 19 residues pruned to eliminate duplicates Z: 28 28.473 2.117 0.489 0.678 0.926 0.741 CB 1.593 27 residues pruned to eliminate duplicates Z: 19 29.344 2.199 0.289 0.906 1.000 0.778 CA 1.735 19 residues pruned to eliminate duplicates Z: 34 33.362 2.126 0.662 0.600 0.939 0.636 CB 1.591 28 residues pruned to eliminate duplicates Z: 21 30.917 2.101 0.556 0.846 1.000 0.650 CA 1.572 21 residues pruned to eliminate duplicates Z: 26 37.642 2.293 0.695 0.693 0.920 0.600 CB 1.765 28 residues pruned to eliminate duplicates Z: 20 34.966 2.180 0.754 0.846 0.947 0.737 CA 1.645 20 residues pruned to eliminate duplicates Z: 28 28.759 2.158 0.608 0.651 0.889 0.704 CB 1.559 28 residues pruned to eliminate duplicates Z: 31 28.349 2.115 0.516 0.587 0.933 0.600 CB 1.591 27 residues pruned to eliminate duplicates Z: 18 35.782 2.288 0.690 0.868 0.941 0.706 CB 1.742 18 residues pruned to eliminate duplicates Z: 25 19.746 2.183 0.461 0.409 0.958 0.708 CB 1.451 Z: 6 4.662 1.800 0.285 0.295 0.800 0.600 CA 1.417 6 residues pruned to eliminate duplicates Z: 44 24.554 2.244 0.569 0.361 0.907 0.628 CB 1.361 25 residues pruned to eliminate duplicates Z: 6 8.727 1.949 0.955 0.411 1.000 0.600 CA 1.124 6 residues pruned to eliminate duplicates Z: 43 24.188 2.260 0.708 0.324 0.881 0.500 CB 1.332 43 residues pruned to eliminate duplicates Z: 26 21.147 2.261 0.489 0.377 0.960 0.640 CB 1.491 26 residues pruned to eliminate duplicates Z: 19 24.085 2.222 0.798 0.516 0.944 0.722 CB 1.481 19 residues pruned to eliminate duplicates Z: 17 16.618 2.278 0.656 0.284 0.938 0.438 CB 1.499 17 residues pruned to eliminate duplicates Z: 26 22.039 2.219 0.617 0.430 0.960 0.640 CB 1.376 26 residues pruned to eliminate duplicates Z: 6 6.858 1.890 0.815 0.299 0.800 0.200 CA 1.399 6 residues pruned to eliminate duplicates Z: 24 21.438 2.219 0.578 0.393 0.957 0.565 CB 1.495 24 residues pruned to eliminate duplicates Z: 52 43.592 2.400 0.766 0.399 0.922 0.667 CB 1.738 52 residues pruned to eliminate duplicates Z: 50 41.378 2.441 0.627 0.447 0.878 0.673 CB 1.791 50 residues pruned to eliminate duplicates Z: 50 43.930 2.460 0.641 0.392 0.959 0.592 CB 1.818 50 residues pruned to eliminate duplicates Z: 50 50.228 2.470 0.860 0.413 0.939 0.714 CB 1.822 50 residues pruned to eliminate duplicates Z: 54 45.024 2.392 0.707 0.440 0.925 0.623 CB 1.744 54 residues pruned to eliminate duplicates Z: 55 45.241 2.372 0.656 0.457 0.926 0.574 CB 1.770 55 residues pruned to eliminate duplicates Z: 107 60.580 2.442 0.638 0.460 0.887 0.575 CB 1.729 107 residues pruned to eliminate duplicates Z: 55 45.399 2.384 0.642 0.449 0.926 0.630 CB 1.796 55 residues pruned to eliminate duplicates Z: 50 44.491 2.472 0.655 0.410 0.939 0.633 CB 1.818 50 residues pruned to eliminate duplicates Z: 50 42.630 2.453 0.686 0.393 0.918 0.571 CB 1.795 50 residues pruned to eliminate duplicates Z: 50 44.854 2.446 0.686 0.413 0.939 0.612 CB 1.814 50 residues pruned to eliminate duplicates Z: 66 49.060 2.386 0.618 0.478 0.938 0.646 CB 1.718 66 residues pruned to eliminate duplicates Z: 57 40.909 2.341 0.597 0.454 0.893 0.661 CB 1.717 57 residues pruned to eliminate duplicates Z: 50 46.913 2.438 0.769 0.422 0.939 0.633 CB 1.795 50 residues pruned to eliminate duplicates Z: 50 42.409 2.450 0.679 0.388 0.918 0.592 CB 1.806 50 residues pruned to eliminate duplicates Z: 104 62.171 2.437 0.707 0.451 0.932 0.553 CB 1.662 104 residues pruned to eliminate duplicates Z: 50 41.199 2.436 0.646 0.387 0.939 0.510 CB 1.764 50 residues pruned to eliminate duplicates Z: 56 41.654 2.308 0.636 0.430 0.945 0.545 CB 1.692 56 residues pruned to eliminate duplicates Z: 101 64.013 2.465 0.686 0.452 0.940 0.570 CB 1.721 101 residues pruned to eliminate duplicates Z: 50 40.068 2.455 0.642 0.384 0.918 0.531 CB 1.750 50 residues pruned to eliminate duplicates Z: 55 43.882 2.370 0.577 0.454 0.944 0.648 CB 1.774 55 residues pruned to eliminate duplicates Z: 31 30.228 2.395 0.613 0.415 0.867 0.633 CB 1.801 31 residues pruned to eliminate duplicates Z: 54 37.367 2.327 0.500 0.428 0.925 0.566 CB 1.714 54 residues pruned to eliminate duplicates Z: 28 26.216 2.376 0.660 0.360 0.815 0.630 CB 1.825 28 residues pruned to eliminate duplicates Z: 67 40.599 2.352 0.486 0.444 0.909 0.561 CB 1.668 67 residues pruned to eliminate duplicates Z: 52 40.436 2.418 0.525 0.395 0.961 0.608 CB 1.786 32 residues pruned to eliminate duplicates Z: 8 6.720 1.752 0.608 0.494 0.857 0.714 CB 1.058 8 residues pruned to eliminate duplicates Z: 58 34.493 2.299 0.596 0.395 0.860 0.649 CB 1.618 58 residues pruned to eliminate duplicates Z: 30 35.294 2.400 0.695 0.430 0.931 0.586 CB 1.861 30 residues pruned to eliminate duplicates Z: 71 41.852 2.273 0.505 0.410 0.943 0.571 CB 1.704 71 residues pruned to eliminate duplicates Z: 56 41.913 2.345 0.653 0.427 0.927 0.618 CB 1.696 56 residues pruned to eliminate duplicates Z: 122 74.903 2.523 0.585 0.511 0.950 0.636 CB 1.772 144 residues pruned to eliminate duplicates Z: 8 17.952 2.223 0.806 0.445 1.000 0.714 CB 1.788 8 residues pruned to eliminate duplicates Z: 89 54.062 2.426 0.629 0.422 0.932 0.693 CB 1.698 89 residues pruned to eliminate duplicates Z: 59 38.464 2.269 0.587 0.414 0.914 0.586 CB 1.680 59 residues pruned to eliminate duplicates Z: 64 41.755 2.387 0.539 0.408 0.937 0.603 CB 1.685 70 residues pruned to eliminate duplicates Z: 52 28.101 2.298 0.544 0.333 0.863 0.529 CB 1.543 52 residues pruned to eliminate duplicates Z: 160 84.703 2.433 0.758 0.478 0.906 0.610 CB 1.772 160 residues pruned to eliminate duplicates Z: 55 42.538 2.356 0.571 0.451 0.963 0.685 CB 1.708 56 residues pruned to eliminate duplicates Z: 8 11.293 2.034 0.997 0.555 0.857 0.571 CA 1.162 8 residues pruned to eliminate duplicates Z: 50 35.904 2.414 0.575 0.366 0.898 0.551 CB 1.735 50 residues pruned to eliminate duplicates Z: 38 31.648 2.391 0.616 0.373 0.892 0.622 CB 1.728 38 residues pruned to eliminate duplicates Z: 59 35.087 2.383 0.501 0.323 0.914 0.517 CB 1.713 59 residues pruned to eliminate duplicates Z: 100 53.941 2.465 0.631 0.406 0.889 0.596 CB 1.674 100 residues pruned to eliminate duplicates Z: 48 36.999 2.428 0.638 0.353 0.936 0.532 CB 1.699 48 residues pruned to eliminate duplicates Z: 120 73.267 2.528 0.665 0.487 0.924 0.580 CB 1.748 120 residues pruned to eliminate duplicates Z: 48 38.637 2.482 0.522 0.451 0.915 0.596 CB 1.714 48 residues pruned to eliminate duplicates Z: 83 51.882 2.460 0.591 0.407 0.927 0.622 CB 1.742 83 residues pruned to eliminate duplicates Z: 106 79.280 2.629 0.800 0.511 0.876 0.648 CA 1.846 106 residues pruned to eliminate duplicates Z: 63 33.293 2.378 0.509 0.316 0.887 0.565 CB 1.628 63 residues pruned to eliminate duplicates Z: 120 64.598 2.494 0.619 0.438 0.899 0.580 CB 1.739 120 residues pruned to eliminate duplicates Z: 14 9.283 2.267 -0.044 0.391 0.923 0.462 CA 1.445 14 residues pruned to eliminate duplicates Z: 104 58.603 2.417 0.669 0.442 0.922 0.621 CB 1.647 104 residues pruned to eliminate duplicates Z: 16 11.378 2.175 0.205 0.436 0.800 0.600 CA 1.498 16 residues pruned to eliminate duplicates Z: 50 48.011 2.499 0.784 0.523 0.898 0.633 CB 1.675 50 residues pruned to eliminate duplicates Z: 35 44.168 2.512 0.883 0.466 0.941 0.588 CA 1.761 35 residues pruned to eliminate duplicates Z: 34 47.496 2.588 0.892 0.496 0.970 0.667 CA 1.749 34 residues pruned to eliminate duplicates Z: 33 38.515 2.560 0.763 0.476 0.875 0.500 CA 1.768 33 residues pruned to eliminate duplicates Z: 72 56.030 2.488 0.596 0.573 0.901 0.620 CB 1.731 72 residues pruned to eliminate duplicates Z: 76 52.675 2.484 0.637 0.458 0.880 0.653 CB 1.773 76 residues pruned to eliminate duplicates Z: 33 46.133 2.592 0.787 0.544 0.969 0.719 CA 1.741 33 residues pruned to eliminate duplicates Z: 49 45.368 2.506 0.675 0.482 0.958 0.667 CB 1.657 49 residues pruned to eliminate duplicates Z: 33 35.743 2.560 0.673 0.447 0.906 0.562 CB 1.719 33 residues pruned to eliminate duplicates Z: 46 45.653 2.572 0.721 0.483 0.956 0.578 CB 1.638 46 residues pruned to eliminate duplicates Z: 38 39.911 2.470 0.784 0.433 0.892 0.595 CA 1.790 38 residues pruned to eliminate duplicates Z: 38 38.424 2.530 0.702 0.437 0.919 0.676 CB 1.704 38 residues pruned to eliminate duplicates Z: 103 57.704 2.424 0.690 0.429 0.882 0.539 CB 1.703 103 residues pruned to eliminate duplicates Z: 56 45.862 2.402 0.747 0.492 0.909 0.582 CB 1.633 56 residues pruned to eliminate duplicates Z: 46 46.519 2.495 0.764 0.537 0.911 0.556 CB 1.667 46 residues pruned to eliminate duplicates Z: 42 51.196 2.613 0.770 0.483 0.976 0.659 CB 1.804 42 residues pruned to eliminate duplicates Z: 50 47.372 2.488 0.755 0.477 0.980 0.612 CB 1.620 50 residues pruned to eliminate duplicates Z: 67 69.774 2.635 0.790 0.589 0.939 0.636 CA 1.779 67 residues pruned to eliminate duplicates Z: 34 46.572 2.594 0.829 0.487 0.970 0.606 CA 1.786 34 residues pruned to eliminate duplicates Z: 70 67.911 2.614 0.687 0.589 0.971 0.696 CA 1.753 70 residues pruned to eliminate duplicates Z: 66 64.749 2.603 0.718 0.611 0.923 0.708 CB 1.751 66 residues pruned to eliminate duplicates Z: 66 67.910 2.630 0.717 0.599 0.938 0.723 CA 1.809 66 residues pruned to eliminate duplicates Z: 33 47.607 2.688 0.783 0.486 0.969 0.688 CA 1.837 33 residues pruned to eliminate duplicates Z: 67 47.896 2.494 0.620 0.406 0.894 0.515 CB 1.801 67 residues pruned to eliminate duplicates Z: 47 42.991 2.562 0.588 0.466 0.935 0.587 CB 1.724 47 residues pruned to eliminate duplicates Z: 52 40.157 2.418 0.612 0.490 0.882 0.647 CB 1.651 52 residues pruned to eliminate duplicates Z: 49 41.588 2.519 0.676 0.456 0.896 0.646 CB 1.660 49 residues pruned to eliminate duplicates Z: 47 33.766 2.540 0.608 0.450 0.826 0.565 CB 1.553 47 residues pruned to eliminate duplicates Z: 30 13.798 2.171 0.709 0.330 0.690 0.379 CB 1.207 7 residues pruned to eliminate duplicates Z: 9 8.258 1.908 0.492 0.575 0.875 0.375 CA 1.090 9 residues pruned to eliminate duplicates Z: 60 57.672 2.660 0.717 0.553 0.898 0.627 CA 1.737 93 residues pruned to eliminate duplicates Z: 50 43.534 2.492 0.715 0.463 0.918 0.531 CB 1.646 50 residues pruned to eliminate duplicates Z: 68 61.761 2.627 0.685 0.560 0.910 0.612 CA 1.765 68 residues pruned to eliminate duplicates Z: 49 46.239 2.564 0.722 0.465 0.896 0.562 CB 1.749 49 residues pruned to eliminate duplicates Z: 61 58.358 2.630 0.640 0.543 0.933 0.633 CA 1.796 61 residues pruned to eliminate duplicates Z: 65 68.708 2.716 0.649 0.593 0.969 0.656 CA 1.811 65 residues pruned to eliminate duplicates Z: 8 13.266 2.371 0.554 0.611 0.857 0.714 CA 1.429 8 residues pruned to eliminate duplicates Z: 9 15.863 2.283 0.906 0.575 0.750 0.500 N 1.599 9 residues pruned to eliminate duplicates Z: 43 63.470 2.734 0.614 0.743 0.952 0.762 CA 1.875 43 residues pruned to eliminate duplicates Z: 8 14.361 2.423 0.378 0.592 0.857 0.571 CA 1.736 8 residues pruned to eliminate duplicates Z: 79 73.716 2.657 0.746 0.579 0.897 0.679 CA 1.858 79 residues pruned to eliminate duplicates Z: 48 50.010 2.617 0.548 0.689 0.894 0.723 CA 1.695 48 residues pruned to eliminate duplicates Z: 52 59.772 2.552 0.783 0.637 0.902 0.745 CA 1.793 52 residues pruned to eliminate duplicates Z: 35 48.825 2.675 0.407 0.807 0.941 0.882 CA 1.809 35 residues pruned to eliminate duplicates Z: 27 33.004 2.466 0.877 0.664 0.846 0.808 CA 1.420 Z: 6 6.783 2.281 0.748 0.445 0.600 0.400 CA 1.343 6 residues pruned to eliminate duplicates Z: 24 45.512 2.675 0.921 0.712 0.913 0.696 CA 1.670 27 residues pruned to eliminate duplicates Z: 22 46.437 2.679 0.682 0.817 1.000 0.714 CA 1.707 22 residues pruned to eliminate duplicates Z: 21 51.507 2.770 0.931 0.816 0.950 0.750 CA 1.722 23 residues pruned to eliminate duplicates Z: 19 51.199 2.630 0.974 0.903 1.000 0.667 CA 1.657 19 residues pruned to eliminate duplicates Z: 37 47.622 2.651 0.667 0.582 0.889 0.667 CA 1.867 66 residues pruned to eliminate duplicates Z: 24 45.620 2.626 0.978 0.725 0.913 0.565 CA 1.637 Z: 20 58.097 2.592 1.370 0.920 1.000 0.789 CA 1.528 21 residues pruned to eliminate duplicates Z: 20 52.423 2.587 1.223 0.889 0.947 0.684 CA 1.589 23 residues pruned to eliminate duplicates Z: 21 49.968 2.447 1.075 0.921 0.950 0.700 CA 1.630 21 residues pruned to eliminate duplicates Z: 23 59.958 2.676 1.215 0.758 1.000 0.727 CA 1.714 21 residues pruned to eliminate duplicates Z: 19 59.738 2.697 1.236 0.934 0.944 0.667 CA 1.723 19 residues pruned to eliminate duplicates Z: 26 54.977 2.552 1.213 0.687 0.880 0.520 CA 1.864 24 residues pruned to eliminate duplicates Z: 17 58.505 2.599 1.376 0.944 0.938 0.500 CA 1.749 17 residues pruned to eliminate duplicates Z: 22 67.479 2.729 1.373 0.797 0.952 0.524 CA 1.840 24 residues pruned to eliminate duplicates Z: 16 57.948 2.611 1.726 0.934 0.933 0.600 CA 1.571 17 residues pruned to eliminate duplicates Z: 18 80.694 2.726 1.673 0.948 0.941 0.588 CA 1.972 18 residues pruned to eliminate duplicates Z: 19 70.077 2.705 1.400 0.925 1.000 0.444 CA 1.786 19 residues pruned to eliminate duplicates Z: 86 80.772 2.563 0.942 0.579 0.918 0.565 CB 1.778 107 residues pruned to eliminate duplicates Z: 24 54.962 2.607 1.183 0.724 0.870 0.391 CB 1.892 Z: 7 9.524 1.828 0.750 0.478 0.833 0.500 N 1.491 7 residues pruned to eliminate duplicates Z: 24 14.518 2.030 0.516 0.321 0.783 0.478 CB 1.531 24 residues pruned to eliminate duplicates Z: 14 14.412 2.237 0.572 0.358 0.846 0.538 CB 1.566 14 residues pruned to eliminate duplicates Z: 18 16.273 2.129 0.571 0.390 0.941 0.529 CB 1.409 18 residues pruned to eliminate duplicates Z: 76 59.300 2.518 0.756 0.500 0.867 0.613 CB 1.788 98 residues pruned to eliminate duplicates Z: 16 14.582 2.172 0.589 0.341 0.867 0.267 CB 1.497 Z: 6 4.065 1.397 0.312 0.440 1.000 0.400 CB 1.055 6 residues pruned to eliminate duplicates Z: 9 18.951 2.144 0.714 0.863 1.000 0.875 CB 1.338 9 residues pruned to eliminate duplicates Z: 10 21.255 2.275 0.725 0.683 1.000 0.889 CB 1.526 10 residues pruned to eliminate duplicates Z: 19 15.367 2.142 0.971 0.479 0.889 0.611 CB 0.986 19 residues pruned to eliminate duplicates Z: 11 19.760 2.366 0.615 0.657 0.900 0.800 CB 1.571 11 residues pruned to eliminate duplicates Z: 9 20.374 2.486 0.588 0.629 1.000 0.750 CB 1.617 9 residues pruned to eliminate duplicates Z: 19 12.139 2.112 0.660 0.460 0.722 0.444 CB 1.177 16 residues pruned to eliminate duplicates Z: 11 23.658 2.244 0.730 0.705 1.000 0.900 CB 1.599 11 residues pruned to eliminate duplicates Z: 10 19.880 2.414 0.386 0.790 1.000 0.889 CB 1.535 13 residues pruned to eliminate duplicates Z: 14 21.597 2.173 0.914 0.826 0.846 0.538 CA 1.284 14 residues pruned to eliminate duplicates Z: 27 44.446 2.830 0.754 0.762 1.000 0.846 CA 1.392 27 residues pruned to eliminate duplicates Z: 49 67.633 2.804 0.846 0.694 0.958 0.771 CA 1.648 49 residues pruned to eliminate duplicates Z: 35 45.736 2.754 0.657 0.683 0.941 0.765 CA 1.544 35 residues pruned to eliminate duplicates Z: 53 70.043 2.742 0.886 0.659 0.962 0.654 CA 1.685 53 residues pruned to eliminate duplicates Z: 31 47.484 2.602 1.156 0.640 0.933 0.700 CA 1.452 31 residues pruned to eliminate duplicates Z: 38 43.019 2.439 1.077 0.547 0.892 0.568 CA 1.495 38 residues pruned to eliminate duplicates Z: 78 88.237 2.794 0.892 0.605 0.896 0.662 CA 1.921 78 residues pruned to eliminate duplicates Z: 47 70.989 2.822 0.949 0.713 0.935 0.761 CA 1.678 47 residues pruned to eliminate duplicates Z: 19 29.520 2.641 0.850 0.582 0.833 0.556 CA 1.580 19 residues pruned to eliminate duplicates Z: 20 25.088 2.664 0.692 0.613 0.842 0.579 CA 1.363 20 residues pruned to eliminate duplicates Z: 133 110.237 2.642 0.801 0.633 0.939 0.705 CA 1.894 133 residues pruned to eliminate duplicates Z: 48 75.193 2.852 1.044 0.727 0.936 0.830 CA 1.638 48 residues pruned to eliminate duplicates Z: 37 78.013 2.946 1.035 0.724 0.972 0.889 CA 1.823 37 residues pruned to eliminate duplicates Z: 50 69.921 2.794 0.897 0.703 0.959 0.735 CA 1.633 50 residues pruned to eliminate duplicates Z: 77 98.083 2.809 1.092 0.622 0.895 0.671 CA 1.906 77 residues pruned to eliminate duplicates Z: 28 62.350 2.767 1.117 0.718 1.000 0.741 CA 1.682 28 residues pruned to eliminate duplicates Z: 128 106.167 2.656 0.897 0.627 0.913 0.685 CA 1.817 128 residues pruned to eliminate duplicates Z: 131 105.215 2.611 0.936 0.610 0.869 0.638 CA 1.892 131 residues pruned to eliminate duplicates Z: 121 110.207 2.658 0.944 0.640 0.942 0.708 CA 1.812 121 residues pruned to eliminate duplicates Z: 51 74.432 2.808 0.995 0.684 0.920 0.660 CA 1.725 51 residues pruned to eliminate duplicates Z: 45 82.095 2.826 1.070 0.695 0.955 0.682 CA 1.855 45 residues pruned to eliminate duplicates Z: 41 76.111 2.810 1.095 0.661 0.950 0.625 CA 1.854 41 residues pruned to eliminate duplicates Z: 151 92.880 2.483 0.814 0.551 0.907 0.667 CA 1.767 167 residues pruned to eliminate duplicates Z: 50 85.240 2.797 1.126 0.705 0.939 0.673 CA 1.809 50 residues pruned to eliminate duplicates Z: 65 91.210 2.762 1.178 0.624 0.891 0.625 CA 1.893 65 residues pruned to eliminate duplicates Z: 46 68.695 2.781 1.150 0.612 0.889 0.733 CA 1.733 46 residues pruned to eliminate duplicates Z: 48 91.651 2.823 1.210 0.732 0.936 0.660 CA 1.858 48 residues pruned to eliminate duplicates Z: 49 85.913 2.809 1.227 0.714 0.896 0.688 CA 1.823 49 residues pruned to eliminate duplicates Z: 39 80.846 2.874 1.220 0.674 0.947 0.605 CA 1.849 39 residues pruned to eliminate duplicates Z: 131 125.263 2.620 1.119 0.630 0.915 0.654 CA 1.913 131 residues pruned to eliminate duplicates Z: 50 79.867 2.819 1.068 0.688 0.918 0.653 CA 1.794 50 residues pruned to eliminate duplicates Z: 61 101.530 2.795 1.289 0.656 0.917 0.567 CA 1.933 61 residues pruned to eliminate duplicates Z: 168 122.410 2.611 0.942 0.585 0.928 0.635 CB 1.856 168 residues pruned to eliminate duplicates Z: 16 56.497 2.951 1.250 0.914 0.933 0.600 CA 1.664 16 residues pruned to eliminate duplicates Z: 47 100.499 2.865 1.309 0.752 0.957 0.652 CA 1.870 47 residues pruned to eliminate duplicates Z: 121 119.537 2.650 1.002 0.647 0.933 0.717 CB 1.921 121 residues pruned to eliminate duplicates Z: 59 95.956 2.813 1.156 0.670 0.914 0.707 CA 1.944 59 residues pruned to eliminate duplicates Z: 50 73.758 2.730 1.071 0.655 0.898 0.490 CA 1.797 50 residues pruned to eliminate duplicates Z: 47 99.468 2.838 1.220 0.733 0.978 0.609 CB 1.930 47 residues pruned to eliminate duplicates Z: 130 118.964 2.630 1.027 0.614 0.907 0.651 CB 1.944 130 residues pruned to eliminate duplicates Z: 29 61.587 2.786 1.202 0.700 0.893 0.536 CA 1.772 29 residues pruned to eliminate duplicates Z: 132 118.523 2.642 1.003 0.639 0.916 0.664 CA 1.877 132 residues pruned to eliminate duplicates Z: 132 120.717 2.657 1.035 0.635 0.908 0.672 CA 1.891 132 residues pruned to eliminate duplicates Z: 58 82.597 2.664 1.162 0.627 0.912 0.474 CB 1.848 58 residues pruned to eliminate duplicates Z: 131 119.027 2.662 1.008 0.644 0.908 0.615 CA 1.881 131 residues pruned to eliminate duplicates Z: 91 95.892 2.696 0.984 0.585 0.922 0.633 CB 1.890 91 residues pruned to eliminate duplicates Z: 139 89.899 2.473 0.802 0.542 0.913 0.652 CB 1.805 139 residues pruned to eliminate duplicates Z: 112 105.275 2.654 0.910 0.631 0.901 0.676 CA 1.935 112 residues pruned to eliminate duplicates Z: 65 88.120 2.840 1.061 0.571 0.875 0.531 CA 2.009 65 residues pruned to eliminate duplicates Z: 31 49.521 2.696 1.033 0.493 0.867 0.600 CA 1.916 31 residues pruned to eliminate duplicates Z: 77 101.855 2.779 1.144 0.590 0.908 0.566 CB 1.982 77 residues pruned to eliminate duplicates Z: 38 75.979 2.782 1.234 0.659 0.865 0.649 CA 2.004 38 residues pruned to eliminate duplicates Z: 91 73.397 2.466 0.740 0.588 0.922 0.700 CB 1.797 91 residues pruned to eliminate duplicates Z: 132 117.179 2.642 0.996 0.631 0.931 0.656 CA 1.844 132 residues pruned to eliminate duplicates Z: 135 111.842 2.640 0.963 0.621 0.910 0.642 CA 1.826 135 residues pruned to eliminate duplicates Z: 31 46.275 2.655 1.026 0.465 0.900 0.600 CB 1.809 31 residues pruned to eliminate duplicates Z: 110 74.414 2.500 0.668 0.535 0.917 0.642 CB 1.801 110 residues pruned to eliminate duplicates Z: 122 111.381 2.626 0.943 0.631 0.934 0.702 CA 1.879 122 residues pruned to eliminate duplicates Z: 122 119.833 2.663 1.005 0.634 0.934 0.653 CA 1.926 122 residues pruned to eliminate duplicates Z: 137 112.327 2.620 0.943 0.619 0.890 0.640 CA 1.901 137 residues pruned to eliminate duplicates Z: 131 115.769 2.683 0.949 0.632 0.915 0.638 CA 1.875 131 residues pruned to eliminate duplicates Z: 35 44.584 2.619 0.870 0.438 0.882 0.500 CB 1.887 35 residues pruned to eliminate duplicates Z: 111 108.678 2.721 0.910 0.624 0.918 0.609 CB 1.932 111 residues pruned to eliminate duplicates Z: 120 109.186 2.657 0.886 0.616 0.933 0.655 CA 1.919 120 residues pruned to eliminate duplicates Z: 57 79.686 2.746 1.158 0.564 0.875 0.536 CA 1.930 57 residues pruned to eliminate duplicates Z: 133 105.385 2.566 0.948 0.620 0.894 0.591 CB 1.832 133 residues pruned to eliminate duplicates Z: 133 111.960 2.625 0.997 0.630 0.871 0.606 CB 1.888 133 residues pruned to eliminate duplicates Z: 101 99.632 2.645 1.011 0.611 0.900 0.580 CA 1.874 101 residues pruned to eliminate duplicates Z: 88 94.651 2.663 1.108 0.575 0.908 0.494 CB 1.852 88 residues pruned to eliminate duplicates Z: 133 120.745 2.658 1.049 0.621 0.902 0.614 CA 1.910 133 residues pruned to eliminate duplicates Z: 131 120.403 2.679 0.968 0.642 0.915 0.677 CA 1.916 131 residues pruned to eliminate duplicates Z: 131 117.526 2.684 0.966 0.640 0.915 0.700 CA 1.871 131 residues pruned to eliminate duplicates Z: 135 116.326 2.614 1.007 0.624 0.910 0.627 CA 1.872 135 residues pruned to eliminate duplicates Z: 131 115.940 2.615 0.984 0.623 0.923 0.600 CA 1.891 131 residues pruned to eliminate duplicates Z: 127 107.884 2.661 0.972 0.593 0.905 0.643 CA 1.852 127 residues pruned to eliminate duplicates Z: 86 80.406 2.549 0.819 0.591 0.941 0.706 CB 1.832 86 residues pruned to eliminate duplicates Z: 84 73.171 2.535 0.725 0.591 0.916 0.687 CA 1.839 84 residues pruned to eliminate duplicates Z: 124 101.746 2.623 0.920 0.586 0.902 0.650 CA 1.858 124 residues pruned to eliminate duplicates Z: 87 101.815 2.705 1.133 0.615 0.895 0.570 CB 1.905 87 residues pruned to eliminate duplicates Z: 131 118.411 2.663 0.989 0.629 0.923 0.623 CB 1.881 131 residues pruned to eliminate duplicates Z: 136 108.763 2.578 0.949 0.616 0.919 0.637 CB 1.818 136 residues pruned to eliminate duplicates Z: 176 121.067 2.572 0.965 0.558 0.891 0.674 CB 1.920 176 residues pruned to eliminate duplicates Z: 84 80.896 2.564 0.807 0.606 0.940 0.651 CB 1.844 84 residues pruned to eliminate duplicates Z: 78 75.805 2.504 0.881 0.607 0.909 0.688 CB 1.823 78 residues pruned to eliminate duplicates Z: 89 110.317 2.751 1.105 0.633 0.932 0.614 CB 1.924 89 residues pruned to eliminate duplicates Z: 132 121.694 2.653 1.023 0.634 0.924 0.649 CA 1.890 132 residues pruned to eliminate duplicates Z: 182 115.605 2.586 0.866 0.544 0.906 0.641 CB 1.883 182 residues pruned to eliminate duplicates Z: 121 113.851 2.658 0.945 0.623 0.933 0.667 CA 1.918 121 residues pruned to eliminate duplicates Z: 84 74.598 2.541 0.788 0.592 0.916 0.627 CB 1.803 84 residues pruned to eliminate duplicates Z: 130 108.134 2.635 0.913 0.621 0.899 0.620 CB 1.874 130 residues pruned to eliminate duplicates Z: 131 117.643 2.678 0.993 0.640 0.915 0.615 CA 1.853 131 residues pruned to eliminate duplicates Z: 63 61.191 2.470 0.742 0.625 0.919 0.694 CB 1.747 63 residues pruned to eliminate duplicates Z: 181 122.382 2.608 0.929 0.564 0.911 0.639 CB 1.871 181 residues pruned to eliminate duplicates Z: 183 125.709 2.598 0.928 0.572 0.912 0.637 CB 1.903 183 residues pruned to eliminate duplicates Z: 164 94.228 2.479 0.762 0.519 0.926 0.632 CB 1.790 164 residues pruned to eliminate duplicates Z: 54 66.136 2.477 0.871 0.696 0.925 0.736 CB 1.772 54 residues pruned to eliminate duplicates Z: 83 71.933 2.504 0.884 0.572 0.890 0.622 CB 1.765 83 residues pruned to eliminate duplicates Z: 83 76.216 2.537 0.853 0.558 0.915 0.659 CB 1.850 83 residues pruned to eliminate duplicates Z: 111 72.750 2.401 0.812 0.540 0.864 0.673 CB 1.774 111 residues pruned to eliminate duplicates Z: 122 110.017 2.606 1.018 0.598 0.917 0.579 CB 1.888 122 residues pruned to eliminate duplicates Z: 87 73.260 2.539 0.769 0.587 0.872 0.663 CB 1.856 87 residues pruned to eliminate duplicates Z: 139 99.215 2.548 0.945 0.583 0.862 0.601 CB 1.825 139 residues pruned to eliminate duplicates Z: 248 138.586 2.606 0.812 0.566 0.931 0.672 CA 1.883 248 residues pruned to eliminate duplicates Z: 88 79.041 2.540 0.859 0.576 0.908 0.632 CA 1.837 88 residues pruned to eliminate duplicates Z: 118 109.769 2.688 0.943 0.603 0.915 0.675 CA 1.926 118 residues pruned to eliminate duplicates Z: 134 103.507 2.618 0.896 0.601 0.895 0.654 CA 1.835 134 residues pruned to eliminate duplicates Z: 60 59.567 2.413 0.817 0.615 0.898 0.678 CA 1.767 60 residues pruned to eliminate duplicates Z: 90 77.538 2.499 0.925 0.570 0.899 0.663 CB 1.776 90 residues pruned to eliminate duplicates Z: 86 79.557 2.553 0.860 0.582 0.906 0.659 CB 1.853 86 residues pruned to eliminate duplicates Z: 85 81.363 2.531 0.909 0.591 0.917 0.631 CA 1.837 85 residues pruned to eliminate duplicates Z: 137 113.600 2.563 0.960 0.609 0.934 0.610 CA 1.872 137 residues pruned to eliminate duplicates Z: 129 112.351 2.667 0.937 0.626 0.930 0.641 CA 1.837 129 residues pruned to eliminate duplicates Z: 85 76.614 2.539 0.803 0.589 0.905 0.679 CB 1.853 85 residues pruned to eliminate duplicates Z: 165 91.073 2.461 0.729 0.518 0.945 0.634 CB 1.737 165 residues pruned to eliminate duplicates Z: 138 111.085 2.633 0.904 0.629 0.912 0.635 CA 1.837 138 residues pruned to eliminate duplicates Z: 85 78.165 2.564 0.872 0.600 0.881 0.643 CB 1.833 85 residues pruned to eliminate duplicates Z: 227 129.644 2.580 0.883 0.553 0.920 0.655 CB 1.831 227 residues pruned to eliminate duplicates Z: 183 124.409 2.575 0.903 0.570 0.918 0.610 CA 1.916 183 residues pruned to eliminate duplicates Z: 84 85.064 2.578 0.900 0.602 0.916 0.651 CA 1.890 84 residues pruned to eliminate duplicates Z: 112 70.917 2.401 0.737 0.511 0.910 0.613 CB 1.754 112 residues pruned to eliminate duplicates Z: 56 70.359 2.488 0.944 0.668 0.927 0.655 CA 1.811 56 residues pruned to eliminate duplicates Z: 25 37.533 2.196 1.051 0.637 0.958 0.458 CB 1.561 25 residues pruned to eliminate duplicates Z: 131 121.231 2.671 1.036 0.630 0.923 0.638 CA 1.874 131 residues pruned to eliminate duplicates Z: 105 78.114 2.464 0.939 0.542 0.875 0.635 CB 1.759 105 residues pruned to eliminate duplicates Z: 133 119.579 2.645 1.081 0.612 0.902 0.591 CA 1.887 133 residues pruned to eliminate duplicates Z: 196 120.243 2.584 0.853 0.563 0.918 0.605 CB 1.844 196 residues pruned to eliminate duplicates Z: 137 120.079 2.629 1.095 0.613 0.904 0.581 CB 1.856 137 residues pruned to eliminate duplicates Z: 131 122.798 2.635 1.139 0.611 0.900 0.608 CB 1.912 131 residues pruned to eliminate duplicates Z: 49 32.084 2.209 0.680 0.467 0.875 0.562 CB 1.474 49 residues pruned to eliminate duplicates Z: 59 34.343 2.255 0.459 0.440 0.948 0.690 CB 1.538 60 residues pruned to eliminate duplicates Z: 9 3.282 1.599 0.228 0.203 0.875 0.500 CA 0.962 Z: 6 4.305 1.639 0.614 0.313 0.800 0.200 CA 1.119 Z: 6 7.493 1.999 0.903 0.365 1.000 0.600 CA 1.018 Z: 7 11.320 2.031 0.646 0.536 1.000 0.833 N 1.335 Z: 7 10.054 2.022 1.121 0.387 0.833 0.500 N 1.295 7 residues pruned to eliminate duplicates Z: 21 15.991 2.170 0.707 0.213 0.900 0.500 CB 1.504 21 residues pruned to eliminate duplicates Z: 21 16.770 2.195 0.654 0.216 0.900 0.450 CB 1.604 27 residues pruned to eliminate duplicates Z: 45 33.136 2.278 0.640 0.474 0.886 0.568 CB 1.549 45 residues pruned to eliminate duplicates Z: 27 23.287 2.228 0.579 0.427 0.885 0.462 CB 1.584 27 residues pruned to eliminate duplicates Z: 59 28.354 2.198 0.591 0.417 0.828 0.603 CB 1.403 59 residues pruned to eliminate duplicates Z: 34 21.759 2.136 0.524 0.407 0.848 0.606 CB 1.512 34 residues pruned to eliminate duplicates Z: 60 33.881 2.219 0.536 0.494 0.881 0.576 CB 1.477 81 residues pruned to eliminate duplicates Z: 9 7.239 1.879 0.576 0.610 0.750 0.750 CA 1.038 9 residues pruned to eliminate duplicates Z: 81 35.830 2.230 0.467 0.466 0.875 0.550 CB 1.449 81 residues pruned to eliminate duplicates Z: 59 37.836 2.255 0.683 0.472 0.914 0.638 CB 1.473 59 residues pruned to eliminate duplicates Z: 65 31.574 2.207 0.542 0.407 0.875 0.625 CB 1.462 65 residues pruned to eliminate duplicates Z: 59 33.932 2.173 0.669 0.418 0.931 0.638 CB 1.437 59 residues pruned to eliminate duplicates Z: 76 32.804 2.204 0.523 0.394 0.893 0.520 CB 1.413 60 residues pruned to eliminate duplicates Z: 12 32.506 2.211 0.718 0.890 1.000 0.636 N 1.856 12 residues pruned to eliminate duplicates Z: 63 33.440 2.251 0.573 0.435 0.871 0.532 CB 1.472 63 residues pruned to eliminate duplicates Z: 74 36.112 2.233 0.558 0.399 0.904 0.603 CB 1.495 73 residues pruned to eliminate duplicates Z: 13 26.536 2.108 0.708 0.914 0.917 0.750 CA 1.641 13 residues pruned to eliminate duplicates Z: 47 32.722 2.227 0.820 0.468 0.870 0.630 CB 1.414 47 residues pruned to eliminate duplicates Z: 51 29.624 2.227 0.534 0.416 0.860 0.600 CB 1.556 51 residues pruned to eliminate duplicates Z: 84 36.166 2.220 0.502 0.443 0.855 0.530 CB 1.475 84 residues pruned to eliminate duplicates Z: 84 39.620 2.251 0.487 0.461 0.916 0.602 CB 1.476 84 residues pruned to eliminate duplicates Z: 74 34.114 2.229 0.495 0.381 0.877 0.521 CB 1.551 74 residues pruned to eliminate duplicates Z: 66 28.190 2.167 0.581 0.412 0.862 0.477 CB 1.299 66 residues pruned to eliminate duplicates Z: 47 26.431 2.208 0.548 0.412 0.870 0.630 CB 1.439 47 residues pruned to eliminate duplicates Z: 54 27.192 2.211 0.599 0.403 0.887 0.642 CB 1.320 54 residues pruned to eliminate duplicates Z: 44 27.802 2.240 0.707 0.459 0.884 0.605 CB 1.309 44 residues pruned to eliminate duplicates Z: 32 27.793 2.184 0.447 0.606 0.935 0.548 CB 1.526 32 residues pruned to eliminate duplicates Z: 34 23.248 2.295 0.512 0.458 0.879 0.545 CB 1.385 34 residues pruned to eliminate duplicates Z: 40 27.055 2.240 0.590 0.544 0.872 0.590 CB 1.337 40 residues pruned to eliminate duplicates Z: 71 31.119 2.213 0.507 0.381 0.857 0.586 CB 1.477 71 residues pruned to eliminate duplicates Z: 91 54.846 2.373 0.609 0.521 0.922 0.622 CB 1.608 91 residues pruned to eliminate duplicates Z: 66 36.750 2.250 0.536 0.449 0.892 0.538 CB 1.557 66 residues pruned to eliminate duplicates Z: 55 28.602 2.211 0.568 0.384 0.870 0.630 CB 1.460 55 residues pruned to eliminate duplicates Z: 59 36.475 2.197 0.733 0.426 0.931 0.621 CB 1.460 59 residues pruned to eliminate duplicates Z: 74 37.670 2.257 0.623 0.390 0.904 0.521 CB 1.495 74 residues pruned to eliminate duplicates Z: 76 33.717 2.197 0.647 0.354 0.907 0.493 CB 1.390 82 residues pruned to eliminate duplicates Z: 9 10.128 1.933 0.436 0.571 0.875 0.500 CA 1.376 9 residues pruned to eliminate duplicates Z: 65 41.824 2.299 0.591 0.493 0.969 0.609 CB 1.486 65 residues pruned to eliminate duplicates Z: 84 39.981 2.272 0.491 0.450 0.916 0.627 CB 1.490 84 residues pruned to eliminate duplicates Z: 84 48.850 2.321 0.633 0.517 0.880 0.663 CB 1.582 84 residues pruned to eliminate duplicates Z: 73 50.487 2.388 0.667 0.521 0.903 0.625 CB 1.622 73 residues pruned to eliminate duplicates Z: 63 35.991 2.276 0.515 0.507 0.903 0.548 CB 1.456 63 residues pruned to eliminate duplicates Z: 97 35.350 2.207 0.478 0.361 0.865 0.510 CB 1.486 97 residues pruned to eliminate duplicates Z: 71 41.332 2.273 0.528 0.509 0.900 0.714 CB 1.566 71 residues pruned to eliminate duplicates Z: 99 44.676 2.258 0.607 0.432 0.918 0.571 CB 1.453 99 residues pruned to eliminate duplicates Z: 81 42.507 2.297 0.585 0.475 0.913 0.600 CB 1.467 81 residues pruned to eliminate duplicates Z: 62 38.460 2.270 0.525 0.487 0.902 0.525 CB 1.599 62 residues pruned to eliminate duplicates Z: 54 28.459 2.269 0.528 0.378 0.887 0.509 CB 1.448 54 residues pruned to eliminate duplicates Z: 24 17.661 2.358 0.146 0.416 0.913 0.522 CB 1.629 24 residues pruned to eliminate duplicates Z: 40 38.293 2.366 0.710 0.478 0.872 0.590 CA 1.778 40 residues pruned to eliminate duplicates Z: 16 13.916 2.391 0.234 0.433 0.800 0.600 CB 1.632 16 residues pruned to eliminate duplicates Z: 79 39.061 2.277 0.538 0.418 0.910 0.526 CB 1.511 79 residues pruned to eliminate duplicates Z: 63 36.217 2.280 0.545 0.483 0.919 0.645 CB 1.446 63 residues pruned to eliminate duplicates Z: 123 57.693 2.325 0.732 0.452 0.877 0.598 CB 1.553 123 residues pruned to eliminate duplicates Z: 57 25.145 2.200 0.496 0.371 0.857 0.536 CB 1.367 57 residues pruned to eliminate duplicates Z: 64 48.407 2.425 0.658 0.533 0.905 0.619 CB 1.623 64 residues pruned to eliminate duplicates Z: 23 16.598 2.392 0.465 0.398 0.727 0.545 CB 1.546 23 residues pruned to eliminate duplicates Z: 89 58.122 2.491 0.711 0.467 0.875 0.557 CB 1.719 417 residues pruned to eliminate duplicates Z: 24 16.912 2.248 0.282 0.369 0.870 0.522 CB 1.619 Z: 6 5.451 1.613 0.540 0.468 1.000 0.800 CA 1.013 6 residues pruned to eliminate duplicates Z: 10 8.401 1.978 0.371 0.315 0.889 0.778 CB 1.427 9 residues pruned to eliminate duplicates Z: 22 41.130 2.587 0.640 0.844 0.952 0.905 CA 1.653 22 residues pruned to eliminate duplicates Z: 57 63.548 2.691 0.708 0.550 0.929 0.607 CB 1.896 57 residues pruned to eliminate duplicates Z: 30 40.455 2.591 0.791 0.595 0.897 0.690 CA 1.649 30 residues pruned to eliminate duplicates Z: 129 77.185 2.535 0.711 0.499 0.945 0.594 CB 1.665 102 residues pruned to eliminate duplicates Z: 18 60.283 2.867 1.031 0.933 0.941 0.824 CA 1.862 18 residues pruned to eliminate duplicates Z: 25 45.805 2.540 1.206 0.698 0.917 0.750 CA 1.519 25 residues pruned to eliminate duplicates Z: 22 69.571 2.828 1.263 0.800 0.952 0.762 CA 1.917 22 residues pruned to eliminate duplicates Z: 73 82.597 2.659 0.928 0.589 0.944 0.653 CB 1.847 58 residues pruned to eliminate duplicates Z: 20 79.799 2.642 1.704 0.910 0.947 0.526 CA 1.918 20 residues pruned to eliminate duplicates Z: 23 69.105 2.649 1.489 0.762 0.955 0.591 CA 1.855 23 residues pruned to eliminate duplicates Z: 134 109.409 2.573 0.956 0.641 0.925 0.639 CB 1.786 134 residues pruned to eliminate duplicates Z: 22 82.330 2.812 1.520 0.807 0.952 0.667 CA 2.037 22 residues pruned to eliminate duplicates Z: 29 55.835 2.582 1.338 0.691 0.893 0.643 CB 1.644 29 residues pruned to eliminate duplicates Z: 44 57.101 2.489 1.024 0.579 0.930 0.558 CB 1.722 44 residues pruned to eliminate duplicates Z: 22 57.428 2.723 1.399 0.721 0.810 0.429 CA 1.940 22 residues pruned to eliminate duplicates Z: 25 65.879 2.613 1.524 0.743 0.917 0.542 CA 1.789 25 residues pruned to eliminate duplicates Z: 22 73.957 2.724 1.656 0.753 0.952 0.381 CA 1.868 22 residues pruned to eliminate duplicates Z: 23 73.206 2.697 1.573 0.774 0.955 0.545 CA 1.850 23 residues pruned to eliminate duplicates Z: 23 60.404 2.745 1.241 0.754 0.864 0.500 CA 1.933 23 residues pruned to eliminate duplicates Z: 6 2.487 2.245 0.245 0.403 1.000 0.400 CB 0.441 Z: 6 7.494 1.929 0.922 0.292 1.000 0.800 N 1.141 5 residues pruned to eliminate duplicates Z: 6 7.434 1.952 1.184 0.309 1.000 0.400 N 0.964 Z: 7 11.514 2.126 1.001 0.393 1.000 0.500 N 1.236 6 residues pruned to eliminate duplicates Z: 10 34.380 2.479 1.360 0.674 0.889 0.556 CB 1.877 Z: 10 32.395 2.413 1.369 0.752 0.889 0.444 CA 1.698 10 residues pruned to eliminate duplicates Z: 10 29.920 2.327 1.340 0.820 0.889 0.667 CA 1.561 10 residues pruned to eliminate duplicates Z: 13 21.604 2.422 1.407 0.420 0.750 0.333 CB 1.550 13 residues pruned to eliminate duplicates Z: 90 71.001 2.474 0.864 0.576 0.921 0.607 CB 1.646 11 residues pruned to eliminate duplicates Z: 10 33.140 2.423 1.283 0.725 0.889 0.556 CA 1.834 10 residues pruned to eliminate duplicates Z: 12 33.705 2.354 1.536 0.569 0.909 0.364 CA 1.752 12 residues pruned to eliminate duplicates Z: 46 42.794 2.481 0.968 0.440 0.800 0.578 CB 1.737 35 residues pruned to eliminate duplicates Z: 12 22.894 2.364 1.149 0.609 0.727 0.636 CA 1.685 12 residues pruned to eliminate duplicates Z: 90 75.353 2.481 0.862 0.586 0.933 0.663 CB 1.708 100 residues pruned to eliminate duplicates Z: 9 30.159 2.401 1.167 0.875 0.875 0.875 CA 1.704 9 residues pruned to eliminate duplicates Z: 96 78.801 2.471 0.943 0.582 0.937 0.674 CB 1.661 96 residues pruned to eliminate duplicates Z: 9 28.550 2.580 1.040 0.763 0.875 0.625 CA 1.735 9 residues pruned to eliminate duplicates Z: 98 75.623 2.464 0.977 0.573 0.887 0.567 CB 1.657 102 residues pruned to eliminate duplicates Z: 11 28.445 2.373 1.125 0.600 0.900 0.900 CA 1.802 11 residues pruned to eliminate duplicates Z: 105 102.719 2.591 1.186 0.601 0.894 0.529 CB 1.807 37 residues pruned to eliminate duplicates Z: 6 3.800 1.712 0.847 0.266 0.600 0.400 CA 1.168 6 residues pruned to eliminate duplicates Z: 61 63.238 2.549 0.980 0.547 0.867 0.533 CB 1.783 61 residues pruned to eliminate duplicates Z: 36 55.901 2.656 1.122 0.447 0.914 0.543 CB 1.937 36 residues pruned to eliminate duplicates Z: 91 75.473 2.501 0.866 0.576 0.911 0.667 CB 1.738 91 residues pruned to eliminate duplicates Z: 29 50.899 2.698 1.060 0.463 0.929 0.571 CA 1.935 29 residues pruned to eliminate duplicates Z: 53 50.743 2.450 0.980 0.403 0.885 0.558 CB 1.817 53 residues pruned to eliminate duplicates Z: 106 90.731 2.576 1.105 0.582 0.886 0.505 CB 1.704 106 residues pruned to eliminate duplicates Z: 8 11.084 1.803 0.768 0.519 1.000 0.571 N 1.290 8 residues pruned to eliminate duplicates Z: 138 93.270 2.499 0.915 0.612 0.891 0.606 CB 1.682 138 residues pruned to eliminate duplicates Z: 136 90.743 2.510 0.917 0.626 0.896 0.622 CB 1.609 136 residues pruned to eliminate duplicates Z: 84 82.336 2.535 1.069 0.602 0.928 0.470 CB 1.686 84 residues pruned to eliminate duplicates Z: 63 50.117 2.379 0.641 0.644 0.919 0.597 CB 1.550 63 residues pruned to eliminate duplicates Z: 75 65.243 2.525 0.851 0.515 0.892 0.568 CB 1.793 75 residues pruned to eliminate duplicates Z: 72 54.975 2.348 0.819 0.579 0.915 0.648 CB 1.546 75 residues pruned to eliminate duplicates Z: 19 39.453 2.534 0.673 0.847 0.944 0.833 CB 1.725 19 residues pruned to eliminate duplicates Z: 107 103.792 2.626 1.046 0.631 0.925 0.651 CB 1.794 107 residues pruned to eliminate duplicates Z: 106 74.239 2.441 0.933 0.518 0.905 0.610 CB 1.667 106 residues pruned to eliminate duplicates Z: 91 69.053 2.482 0.835 0.557 0.889 0.544 CB 1.701 91 residues pruned to eliminate duplicates Z: 62 61.584 2.396 0.891 0.661 0.951 0.738 CB 1.576 62 residues pruned to eliminate duplicates Z: 62 55.494 2.394 0.729 0.659 0.934 0.672 CB 1.585 62 residues pruned to eliminate duplicates Z: 74 66.142 2.547 0.867 0.524 0.904 0.616 CB 1.758 74 residues pruned to eliminate duplicates Z: 62 51.504 2.397 0.674 0.652 0.934 0.689 CB 1.527 62 residues pruned to eliminate duplicates Z: 66 54.225 2.333 0.773 0.607 0.923 0.677 CB 1.592 66 residues pruned to eliminate duplicates Z: 97 77.941 2.480 0.935 0.551 0.927 0.656 CB 1.701 97 residues pruned to eliminate duplicates Z: 77 59.465 2.412 0.773 0.603 0.895 0.697 CB 1.616 77 residues pruned to eliminate duplicates Z: 133 86.328 2.469 0.924 0.596 0.886 0.553 CB 1.629 133 residues pruned to eliminate duplicates Z: 68 53.887 2.336 0.788 0.607 0.925 0.657 CB 1.539 68 residues pruned to eliminate duplicates Z: 72 53.150 2.318 0.769 0.576 0.944 0.704 CB 1.515 72 residues pruned to eliminate duplicates Z: 48 38.996 2.352 0.634 0.603 0.915 0.596 CB 1.466 48 residues pruned to eliminate duplicates Z: 36 42.843 2.430 0.735 0.651 0.886 0.686 CB 1.685 36 residues pruned to eliminate duplicates Z: 66 47.294 2.359 0.637 0.609 0.923 0.662 CB 1.485 66 residues pruned to eliminate duplicates Z: 63 53.041 2.380 0.658 0.645 0.952 0.677 CB 1.566 63 residues pruned to eliminate duplicates Z: 36 46.056 2.460 0.693 0.660 0.943 0.743 CB 1.709 36 residues pruned to eliminate duplicates Z: 64 50.798 2.367 0.693 0.622 0.921 0.587 CB 1.546 64 residues pruned to eliminate duplicates Z: 98 74.321 2.483 0.864 0.561 0.918 0.629 CB 1.674 98 residues pruned to eliminate duplicates Z: 81 66.860 2.436 0.803 0.593 0.950 0.688 CB 1.640 81 residues pruned to eliminate duplicates Z: 65 45.845 2.352 0.686 0.592 0.875 0.625 CB 1.512 65 residues pruned to eliminate duplicates Z: 63 48.989 2.371 0.653 0.623 0.935 0.677 CB 1.512 63 residues pruned to eliminate duplicates Z: 105 69.128 2.441 0.884 0.514 0.904 0.577 CB 1.608 105 residues pruned to eliminate duplicates Z: 65 46.759 2.368 0.552 0.602 0.953 0.656 CB 1.514 65 residues pruned to eliminate duplicates Z: 64 47.692 2.377 0.651 0.609 0.889 0.619 CB 1.554 64 residues pruned to eliminate duplicates Z: 66 53.706 2.339 0.760 0.616 0.908 0.677 CB 1.597 66 residues pruned to eliminate duplicates Z: 66 49.035 2.363 0.633 0.609 0.923 0.646 CB 1.540 66 residues pruned to eliminate duplicates Z: 76 54.885 2.505 0.802 0.500 0.827 0.573 CB 1.698 76 residues pruned to eliminate duplicates Z: 62 52.434 2.391 0.680 0.634 0.918 0.738 CB 1.606 62 residues pruned to eliminate duplicates Z: 66 44.312 2.329 0.584 0.596 0.877 0.631 CB 1.550 66 residues pruned to eliminate duplicates Z: 66 53.656 2.358 0.794 0.619 0.923 0.646 CB 1.523 66 residues pruned to eliminate duplicates Z: 63 49.427 2.377 0.671 0.643 0.887 0.710 CB 1.559 63 residues pruned to eliminate duplicates Z: 137 99.446 2.507 0.981 0.624 0.912 0.618 CB 1.675 137 residues pruned to eliminate duplicates Z: 79 66.483 2.473 0.769 0.591 0.923 0.667 CB 1.708 79 residues pruned to eliminate duplicates Z: 65 46.667 2.339 0.606 0.621 0.922 0.672 CB 1.503 65 residues pruned to eliminate duplicates Z: 65 51.254 2.367 0.774 0.611 0.906 0.656 CB 1.515 65 residues pruned to eliminate duplicates Z: 66 57.229 2.359 0.791 0.622 0.969 0.646 CB 1.545 66 residues pruned to eliminate duplicates Z: 67 52.646 2.328 0.747 0.598 0.955 0.621 CB 1.522 67 residues pruned to eliminate duplicates Z: 37 28.032 2.105 0.919 0.497 0.861 0.389 CB 1.348 37 residues pruned to eliminate duplicates Z: 96 75.980 2.481 0.945 0.553 0.905 0.589 CB 1.695 96 residues pruned to eliminate duplicates Z: 65 50.165 2.263 0.795 0.606 0.891 0.609 CB 1.566 65 residues pruned to eliminate duplicates Z: 64 52.558 2.373 0.856 0.605 0.905 0.667 CB 1.504 64 residues pruned to eliminate duplicates Z: 55 56.646 2.396 0.846 0.646 0.926 0.648 CB 1.642 55 residues pruned to eliminate duplicates Z: 131 71.684 2.377 0.841 0.489 0.885 0.554 CB 1.642 131 residues pruned to eliminate duplicates Z: 92 68.446 2.480 0.826 0.573 0.912 0.648 CB 1.619 92 residues pruned to eliminate duplicates Z: 102 60.592 2.400 0.812 0.516 0.851 0.505 CB 1.603 102 residues pruned to eliminate duplicates Z: 82 67.440 2.416 0.816 0.594 0.938 0.605 CB 1.664 82 residues pruned to eliminate duplicates Z: 63 55.876 2.400 0.897 0.648 0.887 0.597 CB 1.530 63 residues pruned to eliminate duplicates Z: 64 53.274 2.379 0.737 0.626 0.921 0.651 CB 1.568 64 residues pruned to eliminate duplicates Z: 73 52.870 2.341 0.728 0.556 0.931 0.694 CB 1.568 73 residues pruned to eliminate duplicates Z: 10 5.860 1.915 0.505 0.346 0.778 0.222 CB 1.029 10 residues pruned to eliminate duplicates Z: 100 68.841 2.464 0.917 0.561 0.889 0.616 CB 1.553 100 residues pruned to eliminate duplicates Z: 67 50.148 2.326 0.801 0.600 0.879 0.576 CB 1.525 67 residues pruned to eliminate duplicates Z: 10 7.975 1.894 0.652 0.526 1.000 0.444 CB 0.828 Z: 7 11.907 1.913 0.361 0.865 1.000 0.833 CA 1.368 17 residues pruned to eliminate duplicates Z: 42 21.272 2.278 0.467 0.342 0.854 0.610 CB 1.383 42 residues pruned to eliminate duplicates Z: 43 23.589 2.247 0.519 0.390 0.881 0.595 CB 1.360 44 residues pruned to eliminate duplicates Z: 9 11.687 1.828 0.500 0.834 1.000 0.625 CB 1.129 9 residues pruned to eliminate duplicates Z: 40 25.472 2.296 0.520 0.380 0.923 0.615 CB 1.438 42 residues pruned to eliminate duplicates Z: 10 9.776 2.064 0.323 0.640 0.889 0.556 CB 1.178 10 residues pruned to eliminate duplicates Z: 28 19.478 2.199 0.514 0.422 0.852 0.667 CB 1.433 29 residues pruned to eliminate duplicates Z: 7 6.932 1.626 1.181 0.333 0.833 0.667 CA 1.150 7 residues pruned to eliminate duplicates Z: 16 13.489 2.353 0.473 0.273 0.933 0.667 CB 1.393 16 residues pruned to eliminate duplicates Z: 15 13.242 2.386 0.660 0.205 0.786 0.571 CB 1.612 13 residues pruned to eliminate duplicates Z: 6 5.186 1.487 0.648 0.525 0.800 0.200 N 1.155 6 residues pruned to eliminate duplicates Z: 41 22.069 2.261 0.536 0.317 0.925 0.525 CB 1.330 43 residues pruned to eliminate duplicates Z: 8 8.175 2.201 0.263 0.480 0.857 0.714 CB 1.323 8 residues pruned to eliminate duplicates Z: 13 9.464 2.339 0.350 0.212 0.917 0.583 CB 1.326 13 residues pruned to eliminate duplicates Z: 14 9.454 2.172 0.527 0.215 0.846 0.615 CB 1.307 14 residues pruned to eliminate duplicates Z: 30 16.212 2.227 0.288 0.368 0.862 0.552 CB 1.403 14 residues pruned to eliminate duplicates Z: 7 7.981 2.184 0.370 0.570 0.833 0.833 CB 1.221 7 residues pruned to eliminate duplicates Z: 62 27.666 2.241 0.495 0.417 0.836 0.541 CB 1.379 57 residues pruned to eliminate duplicates Z: 14 21.083 2.011 0.615 0.745 1.000 0.769 CB 1.445 14 residues pruned to eliminate duplicates Z: 27 18.259 2.198 0.429 0.475 0.962 0.654 CB 1.217 27 residues pruned to eliminate duplicates Z: 13 13.253 2.172 0.352 0.540 0.833 0.583 CB 1.502 13 residues pruned to eliminate duplicates Z: 27 16.518 2.215 0.436 0.350 0.885 0.615 CB 1.353 27 residues pruned to eliminate duplicates Z: 15 14.603 2.221 0.351 0.481 0.929 0.571 CB 1.427 15 residues pruned to eliminate duplicates Z: 24 22.712 2.311 0.680 0.365 0.913 0.565 CB 1.544 24 residues pruned to eliminate duplicates Z: 74 36.164 2.274 0.616 0.488 0.877 0.644 CB 1.330 35 residues pruned to eliminate duplicates Z: 12 16.147 1.984 0.810 0.777 0.909 0.545 CB 1.167 12 residues pruned to eliminate duplicates Z: 119 56.088 2.374 0.559 0.482 0.924 0.653 CB 1.538 123 residues pruned to eliminate duplicates Z: 10 17.204 2.118 0.856 0.677 0.778 0.667 CB 1.594 10 residues pruned to eliminate duplicates Z: 47 31.043 2.324 0.584 0.499 0.870 0.522 CB 1.431 47 residues pruned to eliminate duplicates Z: 17 19.366 2.401 0.367 0.500 0.938 0.750 CB 1.573 17 residues pruned to eliminate duplicates Z: 46 34.721 2.308 0.657 0.535 0.889 0.489 CB 1.470 46 residues pruned to eliminate duplicates Z: 58 34.300 2.366 0.398 0.486 0.930 0.754 CB 1.497 58 residues pruned to eliminate duplicates Z: 44 32.797 2.323 0.453 0.528 0.907 0.558 CB 1.589 44 residues pruned to eliminate duplicates Z: 49 34.472 2.357 0.457 0.506 0.979 0.667 CB 1.471 49 residues pruned to eliminate duplicates Z: 61 51.620 2.422 0.741 0.527 0.967 0.650 CB 1.592 61 residues pruned to eliminate duplicates Z: 80 58.323 2.406 0.732 0.564 0.899 0.658 CB 1.647 80 residues pruned to eliminate duplicates Z: 73 38.372 2.313 0.590 0.415 0.931 0.583 CB 1.444 73 residues pruned to eliminate duplicates Z: 63 34.513 2.354 0.504 0.423 0.919 0.565 CB 1.460 63 residues pruned to eliminate duplicates Z: 45 30.674 2.312 0.536 0.454 0.909 0.545 CB 1.501 45 residues pruned to eliminate duplicates Z: 59 34.190 2.360 0.532 0.430 0.931 0.603 CB 1.434 59 residues pruned to eliminate duplicates Z: 24 22.706 2.365 0.664 0.370 0.913 0.652 CB 1.514 24 residues pruned to eliminate duplicates Z: 80 58.637 2.414 0.630 0.571 0.937 0.658 CB 1.671 80 residues pruned to eliminate duplicates Z: 45 30.241 2.361 0.505 0.449 0.864 0.614 CB 1.565 45 residues pruned to eliminate duplicates Z: 71 50.612 2.399 0.657 0.510 0.914 0.714 CB 1.648 71 residues pruned to eliminate duplicates Z: 35 29.155 2.405 0.627 0.421 0.941 0.559 CB 1.474 35 residues pruned to eliminate duplicates Z: 71 38.514 2.337 0.525 0.453 0.914 0.657 CB 1.482 71 residues pruned to eliminate duplicates Z: 33 27.816 2.390 0.493 0.416 0.969 0.688 CB 1.553 33 residues pruned to eliminate duplicates Z: 74 45.954 2.341 0.661 0.467 0.959 0.644 CB 1.491 74 residues pruned to eliminate duplicates Z: 102 58.273 2.375 0.647 0.541 0.921 0.703 CB 1.546 102 residues pruned to eliminate duplicates Z: 44 28.628 2.361 0.576 0.420 0.860 0.581 CB 1.481 44 residues pruned to eliminate duplicates Z: 74 39.015 2.311 0.530 0.424 0.959 0.644 CB 1.458 74 residues pruned to eliminate duplicates Z: 53 29.981 2.288 0.509 0.422 0.923 0.635 CB 1.415 53 residues pruned to eliminate duplicates Z: 33 28.993 2.400 0.572 0.458 0.969 0.625 CB 1.464 33 residues pruned to eliminate duplicates Z: 64 59.611 2.490 0.701 0.586 0.952 0.603 CB 1.714 64 residues pruned to eliminate duplicates Z: 33 23.739 2.303 0.535 0.418 0.875 0.469 CB 1.478 33 residues pruned to eliminate duplicates Z: 64 34.786 2.285 0.485 0.465 0.921 0.556 CB 1.454 64 residues pruned to eliminate duplicates Z: 82 49.048 2.393 0.545 0.541 0.864 0.654 CB 1.638 82 residues pruned to eliminate duplicates Z: 36 44.079 2.538 0.650 0.665 0.857 0.771 CB 1.783 36 residues pruned to eliminate duplicates Z: 69 36.304 2.319 0.581 0.454 0.868 0.529 CB 1.450 69 residues pruned to eliminate duplicates Z: 20 9.352 1.876 0.644 0.267 0.789 0.579 CB 1.149 20 residues pruned to eliminate duplicates Z: 16 16.129 2.285 0.679 0.492 0.733 0.600 CB 1.493 16 residues pruned to eliminate duplicates Z: 35 52.126 2.520 0.880 0.673 0.912 0.618 CB 1.765 35 residues pruned to eliminate duplicates Z: 13 13.468 2.207 0.626 0.384 0.917 0.667 CB 1.337 13 residues pruned to eliminate duplicates Z: 43 33.729 2.386 0.613 0.463 0.976 0.667 CB 1.438 43 residues pruned to eliminate duplicates Z: 11 9.335 2.319 0.620 0.413 0.800 0.700 CB 1.076 11 residues pruned to eliminate duplicates Z: 15 12.361 2.094 0.879 0.302 0.857 0.714 CB 1.221 15 residues pruned to eliminate duplicates 1308 residues left after pruning, divided into chains as follows: A: 12 B: 6 C: 9 D: 8 E: 8 F: 9 G: 8 H: 7 I: 6 J: 10 K: 16 L: 7 M: 6 N: 6 O: 7 P: 20 Q: 200 R: 21 S: 6 T: 24 U: 29 V: 7 W: 62 X: 98 Y: 25 Z: 16 Z: 404 Z: 271 Residues blocked in groups of 6 to fit allocated memory (-u) CC for partial structure against native data = 24.90 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 1.073, Connect. = 0.781 for dens.mod. cycle 1 = 0.300, Contrast = 1.169, Connect. = 0.793 for dens.mod. cycle 2 = 0.300, Contrast = 1.387, Connect. = 0.809 for dens.mod. cycle 3 = 0.300, Contrast = 1.388, Connect. = 0.809 for dens.mod. cycle 4 = 0.300, Contrast = 1.385, Connect. = 0.810 for dens.mod. cycle 5 = 0.300, Contrast = 1.367, Connect. = 0.810 for dens.mod. cycle 6 = 0.300, Contrast = 1.353, Connect. = 0.811 for dens.mod. cycle 7 = 0.300, Contrast = 1.338, Connect. = 0.811 for dens.mod. cycle 8 = 0.300, Contrast = 1.325, Connect. = 0.812 for dens.mod. cycle 9 = 0.300, Contrast = 1.313, Connect. = 0.812 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 17089 peaks > 0.5 sigma used to seed fragment search Space for about 6134 unique residues taking solvent into account 2528 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 26 52.811 2.579 1.039 0.833 0.920 0.560 CA 1.637 B: 22 84.159 2.846 1.308 0.939 1.000 0.667 CA 1.943 C: 9 23.351 2.422 0.832 0.825 1.000 0.875 CA 1.405 D: 9 29.278 2.501 0.918 0.751 1.000 0.875 CA 1.725 9 residues pruned to eliminate duplicates E: 26 74.708 2.681 1.301 0.897 0.960 0.480 CA 1.806 F: 24 47.918 2.471 1.158 0.846 0.783 0.478 CA 1.779 21 residues pruned to eliminate duplicates G: 20 32.142 2.427 0.676 0.909 1.000 0.947 CA 1.287 H: 20 49.440 2.591 0.815 0.882 0.947 0.842 CA 1.842 I: 26 72.758 2.715 1.283 0.904 0.880 0.560 CA 1.901 26 residues pruned to eliminate duplicates J: 26 63.964 2.595 1.040 0.889 1.000 0.760 CA 1.740 26 residues pruned to eliminate duplicates K: 26 53.799 2.540 0.798 0.917 1.000 0.840 CA 1.663 25 residues pruned to eliminate duplicates L: 21 59.077 2.551 0.964 0.918 1.000 0.900 CA 1.860 20 residues pruned to eliminate duplicates M: 50 40.449 2.504 0.485 0.491 0.939 0.551 CB 1.670 N: 9 8.826 2.314 0.151 0.412 0.875 0.500 CB 1.469 O: 26 75.577 2.635 1.190 0.910 0.960 0.440 CA 1.936 26 residues pruned to eliminate duplicates P: 26 66.800 2.581 1.109 0.905 0.960 0.360 CA 1.820 26 residues pruned to eliminate duplicates Q: 24 62.045 2.690 1.071 0.899 0.913 0.783 CA 1.817 24 residues pruned to eliminate duplicates R: 23 56.619 2.666 1.012 0.921 0.864 0.500 CA 1.835 23 residues pruned to eliminate duplicates S: 20 25.046 2.606 0.494 0.473 0.895 0.526 CB 1.695 T: 26 59.817 2.699 0.868 0.876 0.960 0.760 CA 1.796 26 residues pruned to eliminate duplicates U: 9 24.410 2.290 0.624 0.849 1.000 0.750 CB 1.720 V: 19 56.676 2.643 1.053 0.891 0.889 0.500 CA 1.992 21 residues pruned to eliminate duplicates W: 28 49.514 2.485 1.249 0.836 0.852 0.593 CA 1.499 28 residues pruned to eliminate duplicates X: 19 27.239 2.480 0.255 0.942 1.000 1.000 CA 1.430 Y: 9 21.029 2.332 0.601 0.755 1.000 0.625 CA 1.587 9 residues pruned to eliminate duplicates Z: 18 37.948 2.575 0.646 0.939 1.000 0.824 CA 1.509 18 residues pruned to eliminate duplicates Z: 21 44.510 2.533 0.599 0.898 0.950 0.900 CA 1.851 19 residues pruned to eliminate duplicates Z: 24 49.476 2.757 0.778 0.907 0.957 0.870 CA 1.564 24 residues pruned to eliminate duplicates Z: 6 11.555 2.686 0.363 0.786 0.600 0.600 N 1.831 Z: 8 31.801 2.613 0.848 0.808 1.000 0.714 CA 1.904 8 residues pruned to eliminate duplicates Z: 24 32.130 2.207 0.734 0.895 1.000 0.870 CA 1.255 Z: 19 70.457 2.727 1.180 0.917 0.944 0.500 CA 2.087 21 residues pruned to eliminate duplicates Z: 9 18.993 2.398 1.025 0.601 0.875 0.375 CA 1.435 6 residues pruned to eliminate duplicates Z: 20 30.554 2.490 0.406 0.901 1.000 0.842 CA 1.430 Z: 19 47.010 2.588 0.964 0.910 0.944 0.611 CA 1.637 Z: 26 64.582 2.727 0.958 0.910 0.960 0.800 CA 1.787 26 residues pruned to eliminate duplicates Z: 13 13.783 2.261 0.488 0.836 0.750 0.667 CB 1.180 Z: 12 28.977 2.392 0.432 0.858 1.000 0.636 N 1.879 Z: 25 47.224 2.720 0.661 0.901 0.958 0.833 CA 1.589 25 residues pruned to eliminate duplicates Z: 85 71.393 2.557 0.785 0.573 0.905 0.571 CA 1.758 29 residues pruned to eliminate duplicates Z: 47 84.824 2.784 1.176 0.735 0.978 0.630 CA 1.709 Z: 24 64.860 2.702 1.221 0.917 0.957 0.609 CA 1.662 25 residues pruned to eliminate duplicates Z: 20 35.507 2.493 0.713 0.847 1.000 0.632 CA 1.416 20 residues pruned to eliminate duplicates Z: 19 40.698 2.574 0.707 0.919 1.000 0.833 CA 1.538 20 residues pruned to eliminate duplicates Z: 22 41.964 2.391 0.572 0.897 1.000 0.905 CA 1.744 22 residues pruned to eliminate duplicates Z: 18 30.712 2.410 0.925 0.852 0.941 0.824 CA 1.261 18 residues pruned to eliminate duplicates Z: 20 54.871 2.572 0.815 0.859 1.000 0.737 CA 1.984 20 residues pruned to eliminate duplicates Z: 6 8.236 2.226 0.662 0.641 0.800 0.800 CA 1.090 Z: 35 40.890 2.623 0.679 0.453 0.941 0.618 CB 1.774 9 residues pruned to eliminate duplicates Z: 15 33.996 2.605 0.809 0.853 0.929 0.786 CA 1.535 15 residues pruned to eliminate duplicates Z: 18 29.839 2.558 0.466 0.945 1.000 0.824 CA 1.336 18 residues pruned to eliminate duplicates Z: 12 35.147 2.512 0.538 0.897 1.000 0.818 CA 1.963 12 residues pruned to eliminate duplicates Z: 8 22.892 2.549 0.764 0.797 0.857 0.571 CA 1.730 8 residues pruned to eliminate duplicates Z: 20 68.279 2.641 1.190 0.887 0.947 0.632 CA 2.062 20 residues pruned to eliminate duplicates Z: 10 12.448 1.994 0.571 0.780 0.889 0.778 CB 1.164 Z: 21 77.547 2.524 1.425 0.907 1.000 0.500 CA 2.013 20 residues pruned to eliminate duplicates Z: 96 56.394 2.496 0.513 0.518 0.916 0.600 CB 1.643 18 residues pruned to eliminate duplicates Z: 9 35.012 2.545 1.105 0.868 0.875 0.750 N 1.931 Z: 9 18.967 2.404 0.074 0.832 1.000 0.750 CB 1.951 9 residues pruned to eliminate duplicates Z: 30 46.914 2.243 1.169 0.876 0.862 0.552 CA 1.510 19 residues pruned to eliminate duplicates Z: 19 54.572 2.648 0.895 0.875 0.944 0.667 CA 1.973 19 residues pruned to eliminate duplicates Z: 11 28.961 2.235 0.941 0.879 1.000 0.700 CA 1.531 Z: 6 8.585 1.886 0.752 0.759 0.800 0.600 CA 1.154 6 residues pruned to eliminate duplicates Z: 27 61.726 2.562 1.334 0.882 0.846 0.615 CA 1.732 25 residues pruned to eliminate duplicates Z: 26 54.027 2.607 0.758 0.871 0.960 0.800 CA 1.791 26 residues pruned to eliminate duplicates Z: 11 26.095 2.334 0.688 0.857 1.000 0.700 CA 1.544 Z: 11 20.133 2.285 0.287 0.869 1.000 0.900 CA 1.582 11 residues pruned to eliminate duplicates Z: 30 58.920 2.566 1.091 0.791 1.000 0.724 CA 1.579 28 residues pruned to eliminate duplicates Z: 26 75.550 2.571 1.375 0.918 0.920 0.520 CA 1.898 27 residues pruned to eliminate duplicates Z: 21 62.093 2.573 1.300 0.836 0.900 0.500 CA 1.951 21 residues pruned to eliminate duplicates Z: 27 39.991 2.531 0.645 0.878 0.962 0.846 CA 1.422 27 residues pruned to eliminate duplicates Z: 19 32.065 2.432 0.840 0.897 1.000 0.944 CA 1.209 18 residues pruned to eliminate duplicates Z: 7 14.431 2.379 0.166 0.845 1.000 0.833 N 1.578 Z: 6 13.005 2.343 1.082 0.775 0.800 0.600 CA 1.169 Z: 9 28.081 2.436 0.913 0.855 0.875 0.875 CA 1.798 9 residues pruned to eliminate duplicates Z: 11 27.185 2.230 0.906 0.841 0.900 0.800 CA 1.675 11 residues pruned to eliminate duplicates Z: 20 42.067 2.415 1.129 0.860 0.895 0.684 CA 1.543 Z: 21 30.603 2.220 0.360 0.869 0.950 0.750 CA 1.742 Z: 66 51.989 2.665 0.627 0.483 0.862 0.508 CB 1.756 25 residues pruned to eliminate duplicates Z: 139 80.779 2.546 0.621 0.527 0.906 0.717 CB 1.791 64 residues pruned to eliminate duplicates Z: 12 30.475 2.501 0.711 0.832 0.909 0.636 CB 1.774 12 residues pruned to eliminate duplicates Z: 24 47.765 2.623 0.874 0.899 0.957 0.826 CA 1.514 24 residues pruned to eliminate duplicates Z: 13 34.357 2.387 0.514 0.884 1.000 0.667 CA 1.983 13 residues pruned to eliminate duplicates Z: 20 29.871 2.285 0.454 0.909 0.947 0.895 CA 1.546 20 residues pruned to eliminate duplicates Z: 25 65.246 2.739 0.968 0.929 1.000 0.875 CA 1.729 26 residues pruned to eliminate duplicates Z: 133 105.684 2.651 0.924 0.627 0.879 0.636 CB 1.821 136 residues pruned to eliminate duplicates Z: 9 31.040 2.389 1.391 0.808 0.875 0.500 CA 1.678 Z: 12 31.234 2.519 0.356 0.850 1.000 0.727 CA 2.042 12 residues pruned to eliminate duplicates Z: 49 51.464 2.584 0.647 0.523 0.917 0.625 CB 1.861 23 residues pruned to eliminate duplicates Z: 19 41.418 2.409 0.522 0.896 1.000 0.889 CA 1.908 21 residues pruned to eliminate duplicates Z: 97 58.550 2.531 0.539 0.432 0.917 0.573 CB 1.796 59 residues pruned to eliminate duplicates Z: 20 36.065 2.388 0.645 0.947 1.000 1.000 CA 1.456 20 residues pruned to eliminate duplicates Z: 6 5.021 2.159 0.040 0.656 0.600 0.400 N 1.441 6 residues pruned to eliminate duplicates Z: 26 60.547 2.702 0.878 0.906 1.000 0.800 CA 1.697 26 residues pruned to eliminate duplicates Z: 6 4.293 1.807 -0.048 0.716 1.000 0.800 N 0.917 6 residues pruned to eliminate duplicates Z: 11 30.618 2.034 1.194 0.832 1.000 0.500 CB 1.629 11 residues pruned to eliminate duplicates Z: 6 4.471 2.339 -0.108 0.437 0.600 0.400 CA 1.706 Z: 25 67.641 2.639 1.380 0.878 0.958 0.625 CA 1.664 25 residues pruned to eliminate duplicates Z: 24 70.054 2.713 1.355 0.907 1.000 0.609 CA 1.625 24 residues pruned to eliminate duplicates Z: 20 41.171 2.360 0.699 0.855 1.000 0.842 CA 1.739 20 residues pruned to eliminate duplicates Z: 16 31.953 2.580 0.396 0.951 1.000 0.933 CA 1.580 16 residues pruned to eliminate duplicates Z: 21 35.181 2.353 0.473 0.882 1.000 0.800 CA 1.643 21 residues pruned to eliminate duplicates Z: 6 14.545 2.103 0.545 0.769 1.000 0.800 CB 1.577 6 residues pruned to eliminate duplicates Z: 7 20.360 2.686 0.709 0.873 0.833 0.833 CA 1.583 7 residues pruned to eliminate duplicates Z: 6 10.764 2.140 0.745 0.707 1.000 0.400 CA 1.068 Z: 18 26.755 2.485 0.308 0.882 0.941 0.941 CA 1.534 18 residues pruned to eliminate duplicates Z: 10 31.148 2.529 0.843 0.904 0.889 0.667 CA 1.784 10 residues pruned to eliminate duplicates Z: 13 25.014 2.212 0.857 0.785 0.917 0.750 CA 1.492 13 residues pruned to eliminate duplicates Z: 26 55.231 2.526 0.975 0.917 1.000 0.800 CA 1.562 26 residues pruned to eliminate duplicates Z: 34 34.447 2.603 0.579 0.453 0.909 0.455 CB 1.685 34 residues pruned to eliminate duplicates Z: 73 63.826 2.689 0.642 0.478 0.958 0.556 CB 1.818 66 residues pruned to eliminate duplicates Z: 10 13.936 2.108 0.467 0.780 0.778 0.667 CA 1.509 10 residues pruned to eliminate duplicates Z: 27 61.272 2.511 1.137 0.859 0.962 0.462 CA 1.714 27 residues pruned to eliminate duplicates Z: 19 54.672 2.801 1.411 0.947 0.889 0.778 CA 1.484 19 residues pruned to eliminate duplicates Z: 9 24.584 2.490 0.724 0.878 1.000 0.750 CA 1.469 8 residues pruned to eliminate duplicates Z: 74 60.184 2.516 0.727 0.550 0.877 0.534 CA 1.761 26 residues pruned to eliminate duplicates Z: 9 24.155 2.374 1.413 0.735 0.750 0.750 CA 1.610 9 residues pruned to eliminate duplicates Z: 25 35.369 2.217 1.021 0.879 0.875 0.458 CA 1.335 24 residues pruned to eliminate duplicates Z: 19 82.240 2.782 1.413 0.944 1.000 0.722 CA 2.000 20 residues pruned to eliminate duplicates Z: 12 23.455 2.223 0.263 0.885 1.000 0.818 CB 1.819 12 residues pruned to eliminate duplicates Z: 9 13.652 2.227 0.147 0.744 0.875 0.750 CA 1.737 10 residues pruned to eliminate duplicates Z: 19 72.902 2.730 1.355 0.913 1.000 0.611 CA 1.892 19 residues pruned to eliminate duplicates Z: 13 24.272 2.257 0.747 0.858 1.000 0.833 CA 1.309 13 residues pruned to eliminate duplicates Z: 16 32.684 2.181 1.182 0.901 0.933 0.600 CB 1.356 Z: 8 7.677 1.739 0.291 0.758 1.000 0.714 CB 1.027 8 residues pruned to eliminate duplicates Z: 23 35.580 2.196 0.654 0.914 0.955 0.955 CB 1.547 23 residues pruned to eliminate duplicates Z: 18 54.925 2.602 1.215 0.938 0.941 0.647 CA 1.707 18 residues pruned to eliminate duplicates Z: 13 20.147 2.331 0.526 0.825 1.000 0.667 CB 1.234 14 residues pruned to eliminate duplicates Z: 8 24.781 2.580 0.848 0.910 0.857 0.429 CA 1.626 8 residues pruned to eliminate duplicates Z: 25 68.111 2.805 1.011 0.907 0.958 0.750 CA 1.828 25 residues pruned to eliminate duplicates Z: 20 38.126 2.416 0.765 0.809 0.947 0.737 CA 1.654 20 residues pruned to eliminate duplicates Z: 7 9.969 2.253 -0.073 0.715 1.000 0.833 N 1.603 7 residues pruned to eliminate duplicates Z: 10 13.085 2.247 0.791 0.517 0.778 0.778 CA 1.371 Z: 26 62.075 2.643 0.897 0.886 1.000 0.760 CA 1.787 26 residues pruned to eliminate duplicates Z: 21 65.245 2.523 1.314 0.864 0.950 0.500 CB 1.928 21 residues pruned to eliminate duplicates Z: 19 39.319 2.402 0.924 0.883 0.944 0.778 CA 1.535 19 residues pruned to eliminate duplicates Z: 14 23.388 2.143 0.416 0.878 0.923 0.769 CA 1.680 Z: 20 41.136 2.502 0.805 0.873 1.000 0.895 CA 1.522 20 residues pruned to eliminate duplicates Z: 18 27.020 1.914 0.775 0.820 1.000 0.765 CB 1.462 17 residues pruned to eliminate duplicates Z: 12 34.588 2.506 0.719 0.839 0.909 0.545 CB 1.988 12 residues pruned to eliminate duplicates Z: 6 8.700 1.668 1.116 0.608 1.000 0.400 CA 0.995 6 residues pruned to eliminate duplicates Z: 25 59.348 2.751 0.722 0.918 0.958 0.792 CA 1.882 25 residues pruned to eliminate duplicates Z: 20 40.501 2.390 0.718 0.910 1.000 0.895 CA 1.605 20 residues pruned to eliminate duplicates Z: 8 18.326 2.523 0.493 0.748 1.000 0.857 CA 1.473 8 residues pruned to eliminate duplicates Z: 19 29.557 2.483 0.490 0.913 1.000 0.944 CA 1.333 19 residues pruned to eliminate duplicates Z: 7 8.319 1.974 0.580 0.810 0.833 0.667 CB 0.997 7 residues pruned to eliminate duplicates Z: 9 35.202 2.542 1.291 0.834 0.875 0.750 CA 1.830 9 residues pruned to eliminate duplicates Z: 20 54.373 2.560 1.217 0.916 0.947 0.737 CA 1.639 19 residues pruned to eliminate duplicates Z: 162 98.652 2.575 0.759 0.520 0.938 0.658 CA 1.794 164 residues pruned to eliminate duplicates Z: 26 69.792 2.730 1.299 0.888 0.920 0.600 CA 1.742 26 residues pruned to eliminate duplicates Z: 14 35.167 2.162 1.105 0.873 1.000 0.769 CA 1.561 12 residues pruned to eliminate duplicates Z: 20 43.157 2.396 0.919 0.873 1.000 0.684 CA 1.568 20 residues pruned to eliminate duplicates Z: 8 4.991 1.601 0.422 0.750 0.714 0.714 CA 0.927 8 residues pruned to eliminate duplicates Z: 162 120.221 2.636 0.913 0.618 0.925 0.621 CB 1.816 80 residues pruned to eliminate duplicates Z: 19 38.856 2.298 0.810 0.920 1.000 0.667 CB 1.550 Z: 33 27.210 2.537 0.471 0.373 0.875 0.562 CB 1.686 34 residues pruned to eliminate duplicates Z: 10 15.367 2.454 0.784 0.406 0.667 0.333 CA 1.938 12 residues pruned to eliminate duplicates Z: 20 36.944 2.345 0.520 0.867 1.000 0.737 CA 1.740 20 residues pruned to eliminate duplicates Z: 11 22.729 1.934 1.439 0.797 0.800 0.600 CB 1.468 11 residues pruned to eliminate duplicates Z: 24 31.558 2.191 0.852 0.857 0.957 0.696 CA 1.250 24 residues pruned to eliminate duplicates Z: 58 43.920 2.574 0.451 0.477 0.912 0.667 CB 1.748 58 residues pruned to eliminate duplicates Z: 75 55.118 2.446 0.593 0.577 0.932 0.622 CB 1.638 75 residues pruned to eliminate duplicates Z: 30 41.746 2.376 0.750 0.862 0.966 0.793 CA 1.417 30 residues pruned to eliminate duplicates Z: 18 30.111 2.459 0.457 0.923 1.000 0.941 CA 1.432 18 residues pruned to eliminate duplicates Z: 9 24.184 2.281 1.078 0.795 0.875 0.625 CA 1.592 9 residues pruned to eliminate duplicates Z: 27 55.184 2.551 1.043 0.877 0.923 0.500 CA 1.633 26 residues pruned to eliminate duplicates Z: 73 54.352 2.537 0.610 0.483 0.917 0.667 CB 1.741 73 residues pruned to eliminate duplicates Z: 9 13.138 2.379 0.005 0.837 1.000 0.875 CA 1.453 9 residues pruned to eliminate duplicates Z: 20 38.614 2.306 0.653 0.910 1.000 0.737 CB 1.648 20 residues pruned to eliminate duplicates Z: 20 34.029 2.134 0.749 0.849 0.947 0.684 CA 1.637 Z: 86 53.423 2.503 0.562 0.423 0.918 0.612 CB 1.749 86 residues pruned to eliminate duplicates Z: 9 9.645 1.758 1.137 0.660 0.875 0.625 CA 0.894 9 residues pruned to eliminate duplicates Z: 59 68.692 2.576 0.958 0.640 0.862 0.379 CB 1.819 59 residues pruned to eliminate duplicates Z: 27 73.878 2.499 1.359 0.905 0.962 0.462 CB 1.818 27 residues pruned to eliminate duplicates Z: 100 60.010 2.510 0.603 0.438 0.939 0.596 CB 1.701 99 residues pruned to eliminate duplicates Z: 90 77.180 2.670 0.669 0.550 0.921 0.640 CB 1.898 102 residues pruned to eliminate duplicates Z: 17 60.737 2.604 1.174 0.921 1.000 0.438 CA 1.888 17 residues pruned to eliminate duplicates Z: 137 83.074 2.526 0.693 0.536 0.912 0.691 CB 1.763 137 residues pruned to eliminate duplicates Z: 8 27.426 2.534 0.911 0.794 1.000 0.714 CA 1.654 8 residues pruned to eliminate duplicates Z: 19 34.682 2.574 0.554 0.890 1.000 0.722 CA 1.469 19 residues pruned to eliminate duplicates Z: 19 44.809 2.298 0.846 0.909 1.000 0.889 CB 1.766 19 residues pruned to eliminate duplicates Z: 12 18.183 2.330 0.481 0.558 0.818 0.727 CB 1.835 12 residues pruned to eliminate duplicates Z: 6 8.472 1.894 0.511 0.615 0.800 0.400 CA 1.483 6 residues pruned to eliminate duplicates Z: 77 91.567 2.734 0.978 0.614 0.921 0.618 CA 1.893 77 residues pruned to eliminate duplicates Z: 25 60.155 2.683 0.997 0.900 0.958 0.833 CA 1.708 25 residues pruned to eliminate duplicates Z: 6 10.668 2.119 0.675 0.763 0.800 0.600 CB 1.331 Z: 213 114.705 2.617 0.719 0.542 0.925 0.660 CA 1.818 213 residues pruned to eliminate duplicates Z: 20 36.224 2.339 0.466 0.892 1.000 0.789 CA 1.741 20 residues pruned to eliminate duplicates Z: 19 35.216 2.489 0.734 0.854 0.833 0.667 CA 1.704 19 residues pruned to eliminate duplicates Z: 9 14.884 2.283 0.160 0.837 1.000 0.875 CB 1.486 9 residues pruned to eliminate duplicates Z: 26 77.646 2.706 1.299 0.910 1.000 0.720 CA 1.770 26 residues pruned to eliminate duplicates Z: 10 24.598 2.274 0.509 0.891 1.000 0.778 N 1.719 10 residues pruned to eliminate duplicates Z: 83 71.914 2.690 0.680 0.547 0.890 0.634 CB 1.885 67 residues pruned to eliminate duplicates Z: 6 14.640 2.356 0.982 0.602 1.000 1.000 CA 1.273 6 residues pruned to eliminate duplicates Z: 14 35.770 2.208 1.062 0.878 0.923 0.692 N 1.713 14 residues pruned to eliminate duplicates Z: 8 13.775 1.994 0.263 0.818 1.000 0.714 CA 1.568 8 residues pruned to eliminate duplicates Z: 20 32.293 2.068 0.851 0.806 0.895 0.632 CA 1.656 20 residues pruned to eliminate duplicates Z: 12 30.462 2.319 1.192 0.851 0.909 0.455 CA 1.471 12 residues pruned to eliminate duplicates Z: 73 56.707 2.501 0.671 0.558 0.917 0.639 CB 1.649 64 residues pruned to eliminate duplicates Z: 43 29.079 2.392 0.499 0.382 0.905 0.667 CB 1.569 18 residues pruned to eliminate duplicates Z: 18 79.854 2.868 1.779 0.931 1.000 0.588 CA 1.698 18 residues pruned to eliminate duplicates Z: 26 35.999 2.381 0.553 0.717 0.880 0.680 CB 1.818 20 residues pruned to eliminate duplicates Z: 129 89.013 2.522 0.809 0.611 0.922 0.602 CB 1.684 79 residues pruned to eliminate duplicates Z: 135 107.101 2.631 0.868 0.612 0.925 0.649 CB 1.830 135 residues pruned to eliminate duplicates Z: 20 57.582 2.552 1.250 0.927 0.947 0.526 CA 1.702 20 residues pruned to eliminate duplicates Z: 59 52.403 2.601 0.566 0.519 0.931 0.655 CB 1.782 59 residues pruned to eliminate duplicates Z: 25 76.612 2.729 1.281 0.922 0.958 0.750 CA 1.843 25 residues pruned to eliminate duplicates Z: 19 48.857 2.487 1.286 0.860 0.944 0.667 CA 1.577 19 residues pruned to eliminate duplicates Z: 19 46.177 2.406 0.957 0.905 1.000 0.778 CB 1.644 19 residues pruned to eliminate duplicates Z: 10 23.382 2.345 0.837 0.797 0.889 0.667 CB 1.569 10 residues pruned to eliminate duplicates Z: 21 43.343 2.351 0.775 0.903 1.000 0.900 CA 1.655 Z: 20 53.003 2.567 1.027 0.892 1.000 0.737 CA 1.678 20 residues pruned to eliminate duplicates Z: 143 72.398 2.561 0.578 0.484 0.901 0.563 CB 1.695 104 residues pruned to eliminate duplicates Z: 7 6.080 2.055 0.271 0.385 0.833 0.833 N 1.290 Z: 23 17.332 2.331 0.562 0.402 0.773 0.591 CB 1.457 23 residues pruned to eliminate duplicates Z: 13 36.974 2.817 0.921 0.923 1.000 0.917 CA 1.386 13 residues pruned to eliminate duplicates Z: 19 50.761 2.676 0.970 0.915 1.000 0.611 CA 1.604 19 residues pruned to eliminate duplicates Z: 29 56.300 2.521 1.216 0.861 0.929 0.857 CA 1.507 29 residues pruned to eliminate duplicates Z: 13 24.003 2.102 0.468 0.890 0.917 0.750 CB 1.762 13 residues pruned to eliminate duplicates Z: 21 41.453 2.348 0.701 0.881 1.000 0.700 CA 1.679 21 residues pruned to eliminate duplicates Z: 20 34.403 2.466 0.655 0.907 0.947 0.789 CA 1.451 20 residues pruned to eliminate duplicates Z: 26 46.349 2.569 0.807 0.900 0.920 0.760 CA 1.551 26 residues pruned to eliminate duplicates Z: 69 60.286 2.697 0.553 0.543 0.897 0.676 CB 1.866 69 residues pruned to eliminate duplicates Z: 24 57.442 2.595 1.142 0.770 0.957 0.522 CA 1.775 24 residues pruned to eliminate duplicates Z: 18 34.878 2.475 0.455 0.889 1.000 1.000 CB 1.691 18 residues pruned to eliminate duplicates Z: 7 8.935 1.940 0.341 0.544 1.000 0.833 N 1.343 7 residues pruned to eliminate duplicates Z: 7 29.736 2.739 0.802 0.896 1.000 0.667 CA 1.761 7 residues pruned to eliminate duplicates Z: 106 71.875 2.615 0.622 0.523 0.895 0.610 CB 1.806 102 residues pruned to eliminate duplicates Z: 11 4.930 1.954 0.191 0.366 1.000 0.700 CB 0.774 11 residues pruned to eliminate duplicates Z: 7 8.861 1.825 0.645 0.617 1.000 0.833 N 1.078 7 residues pruned to eliminate duplicates Z: 11 35.713 2.364 1.077 0.851 1.000 0.800 CA 1.702 11 residues pruned to eliminate duplicates Z: 22 43.817 2.246 1.088 0.885 0.905 0.810 CB 1.627 22 residues pruned to eliminate duplicates Z: 20 30.724 2.201 0.771 0.863 0.842 0.737 CB 1.575 20 residues pruned to eliminate duplicates Z: 10 18.690 2.198 0.905 0.778 0.889 0.667 CA 1.309 10 residues pruned to eliminate duplicates Z: 26 55.977 2.544 0.917 0.920 1.000 0.840 CA 1.617 26 residues pruned to eliminate duplicates Z: 13 30.375 2.300 1.195 0.845 0.833 0.750 CA 1.549 13 residues pruned to eliminate duplicates Z: 125 73.146 2.595 0.642 0.492 0.871 0.605 CB 1.785 125 residues pruned to eliminate duplicates Z: 25 80.624 2.687 1.320 0.898 0.958 0.500 CA 1.971 25 residues pruned to eliminate duplicates Z: 11 32.277 2.269 0.960 0.855 1.000 0.800 CA 1.694 11 residues pruned to eliminate duplicates Z: 27 30.479 2.520 0.755 0.472 0.885 0.615 CA 1.572 11 residues pruned to eliminate duplicates Z: 100 62.304 2.551 0.631 0.456 0.909 0.596 CB 1.731 103 residues pruned to eliminate duplicates Z: 25 44.694 2.687 0.791 0.905 1.000 0.875 CA 1.350 25 residues pruned to eliminate duplicates Z: 20 39.175 2.436 0.723 0.853 1.000 0.632 CA 1.582 20 residues pruned to eliminate duplicates Z: 10 26.433 2.175 0.659 0.881 1.000 0.667 CB 1.767 10 residues pruned to eliminate duplicates Z: 33 29.004 2.055 0.662 0.763 0.938 0.812 CB 1.268 Z: 20 28.891 2.328 0.243 0.868 1.000 0.947 CA 1.675 20 residues pruned to eliminate duplicates Z: 21 32.413 2.574 0.745 0.865 0.850 0.750 CA 1.391 21 residues pruned to eliminate duplicates Z: 23 59.960 2.869 1.187 0.934 0.955 0.864 CA 1.489 23 residues pruned to eliminate duplicates Z: 7 23.718 2.450 0.733 0.854 1.000 0.833 CA 1.684 7 residues pruned to eliminate duplicates Z: 120 108.994 2.662 0.956 0.622 0.933 0.639 CA 1.833 120 residues pruned to eliminate duplicates Z: 52 53.319 2.528 0.676 0.614 0.922 0.686 CB 1.717 36 residues pruned to eliminate duplicates Z: 24 49.177 2.814 0.854 0.924 0.957 0.739 CA 1.443 24 residues pruned to eliminate duplicates Z: 9 24.347 2.340 0.588 0.858 1.000 0.750 CA 1.705 9 residues pruned to eliminate duplicates Z: 23 62.263 2.836 1.362 0.897 0.909 0.682 CA 1.561 23 residues pruned to eliminate duplicates Z: 19 49.845 2.579 0.982 0.877 0.889 0.611 CB 1.878 19 residues pruned to eliminate duplicates Z: 10 16.725 2.090 0.703 0.723 0.889 0.778 CA 1.441 10 residues pruned to eliminate duplicates Z: 22 46.821 2.214 1.138 0.910 1.000 0.857 CB 1.531 23 residues pruned to eliminate duplicates Z: 12 33.362 2.508 0.459 0.914 1.000 0.636 CB 1.945 12 residues pruned to eliminate duplicates Z: 91 52.749 2.583 0.491 0.442 0.911 0.600 CB 1.683 91 residues pruned to eliminate duplicates Z: 70 62.532 2.525 0.747 0.599 0.942 0.667 CB 1.648 70 residues pruned to eliminate duplicates Z: 8 24.627 2.583 0.802 0.783 0.857 0.714 CB 1.819 8 residues pruned to eliminate duplicates Z: 11 30.699 2.577 0.720 0.901 1.000 0.800 CA 1.563 11 residues pruned to eliminate duplicates Z: 58 89.711 2.707 1.218 0.684 0.930 0.632 CA 1.798 58 residues pruned to eliminate duplicates Z: 21 36.661 2.178 0.704 0.893 1.000 0.900 CB 1.585 21 residues pruned to eliminate duplicates Z: 25 47.118 2.536 0.851 0.934 1.000 1.000 CA 1.428 25 residues pruned to eliminate duplicates Z: 19 50.504 2.661 1.029 0.891 0.889 0.667 CA 1.783 20 residues pruned to eliminate duplicates Z: 26 56.378 2.562 0.943 0.924 1.000 0.800 CA 1.591 26 residues pruned to eliminate duplicates Z: 27 56.911 2.453 1.238 0.911 0.962 0.846 CA 1.498 27 residues pruned to eliminate duplicates Z: 17 53.765 2.818 1.266 0.917 0.938 0.625 CA 1.585 17 residues pruned to eliminate duplicates Z: 20 37.721 2.365 0.767 0.905 1.000 0.895 CA 1.474 20 residues pruned to eliminate duplicates Z: 20 42.155 2.309 0.764 0.869 1.000 0.737 CA 1.735 19 residues pruned to eliminate duplicates Z: 26 54.234 2.626 1.052 0.876 1.000 0.720 CA 1.462 26 residues pruned to eliminate duplicates Z: 20 38.999 2.303 0.933 0.867 0.895 0.579 CB 1.643 20 residues pruned to eliminate duplicates Z: 183 94.340 2.589 0.611 0.510 0.912 0.632 CA 1.820 183 residues pruned to eliminate duplicates Z: 12 33.770 2.461 0.924 0.877 0.818 0.818 CA 1.908 12 residues pruned to eliminate duplicates Z: 12 21.306 2.321 0.616 0.915 0.909 0.727 CA 1.332 12 residues pruned to eliminate duplicates Z: 19 54.529 2.543 1.197 0.926 1.000 0.667 CA 1.613 19 residues pruned to eliminate duplicates Z: 18 32.690 2.436 0.332 0.926 1.000 1.000 CB 1.713 18 residues pruned to eliminate duplicates Z: 9 13.458 2.137 0.634 0.631 0.875 0.750 CB 1.376 9 residues pruned to eliminate duplicates Z: 20 84.428 2.675 1.512 0.943 1.000 0.474 CB 1.998 32 residues pruned to eliminate duplicates Z: 99 62.433 2.507 0.631 0.417 0.949 0.622 CB 1.773 100 residues pruned to eliminate duplicates Z: 14 28.930 2.190 0.611 0.881 1.000 0.923 CB 1.647 14 residues pruned to eliminate duplicates Z: 53 52.552 2.528 0.667 0.574 0.923 0.692 CB 1.744 49 residues pruned to eliminate duplicates Z: 9 33.519 2.499 0.963 0.857 0.875 0.625 N 2.035 9 residues pruned to eliminate duplicates Z: 75 76.281 2.615 1.097 0.575 0.865 0.500 CA 1.740 75 residues pruned to eliminate duplicates Z: 18 41.128 2.421 0.826 0.894 1.000 0.882 CA 1.619 18 residues pruned to eliminate duplicates Z: 46 95.895 2.797 1.336 0.742 0.956 0.600 CA 1.844 49 residues pruned to eliminate duplicates Z: 20 41.280 2.305 0.687 0.917 1.000 0.947 CB 1.718 20 residues pruned to eliminate duplicates Z: 22 38.612 2.296 0.717 0.870 0.952 0.762 CA 1.638 21 residues pruned to eliminate duplicates Z: 22 40.219 2.355 0.677 0.877 1.000 0.810 CA 1.614 22 residues pruned to eliminate duplicates Z: 27 64.030 2.519 1.265 0.845 0.962 0.385 CA 1.702 27 residues pruned to eliminate duplicates Z: 19 35.816 2.415 0.398 0.903 0.944 0.944 CA 1.888 19 residues pruned to eliminate duplicates Z: 22 32.657 2.187 0.519 0.910 1.000 0.810 CB 1.521 22 residues pruned to eliminate duplicates Z: 11 16.580 1.975 0.976 0.777 0.800 0.400 CA 1.315 11 residues pruned to eliminate duplicates Z: 24 25.164 2.105 0.288 0.883 1.000 0.913 CA 1.399 24 residues pruned to eliminate duplicates Z: 34 48.763 2.504 0.897 0.618 0.939 0.576 CB 1.700 34 residues pruned to eliminate duplicates Z: 22 42.699 2.454 0.995 0.764 0.905 0.571 CA 1.664 22 residues pruned to eliminate duplicates Z: 50 42.953 2.473 0.746 0.488 0.939 0.551 CB 1.532 47 residues pruned to eliminate duplicates Z: 57 67.524 2.620 1.009 0.695 0.821 0.518 CB 1.746 57 residues pruned to eliminate duplicates Z: 10 33.041 2.649 0.714 0.883 1.000 0.889 CA 1.753 10 residues pruned to eliminate duplicates Z: 52 45.434 2.527 0.588 0.515 0.941 0.529 CB 1.660 52 residues pruned to eliminate duplicates Z: 16 51.342 2.498 1.328 0.919 0.933 0.533 CA 1.722 16 residues pruned to eliminate duplicates Z: 41 29.365 2.452 0.528 0.365 0.850 0.600 CB 1.686 41 residues pruned to eliminate duplicates Z: 25 25.058 2.570 0.135 0.927 0.958 0.917 CA 1.283 25 residues pruned to eliminate duplicates Z: 14 30.496 2.136 0.949 0.878 1.000 0.769 CA 1.474 14 residues pruned to eliminate duplicates Z: 21 43.610 2.310 0.823 0.916 1.000 0.750 CB 1.635 21 residues pruned to eliminate duplicates Z: 26 16.221 1.953 0.468 0.420 0.800 0.600 CA 1.537 Z: 22 39.254 2.341 0.556 0.893 1.000 0.857 CA 1.688 22 residues pruned to eliminate duplicates Z: 23 67.665 2.722 1.317 0.919 1.000 0.545 CA 1.612 23 residues pruned to eliminate duplicates Z: 15 28.932 2.546 0.900 0.425 0.857 0.571 CA 2.015 15 residues pruned to eliminate duplicates Z: 20 38.951 2.219 0.873 0.900 1.000 0.895 CB 1.536 20 residues pruned to eliminate duplicates Z: 65 47.704 2.491 0.673 0.437 0.906 0.609 CB 1.684 50 residues pruned to eliminate duplicates Z: 20 56.952 2.523 1.132 0.926 1.000 0.579 CA 1.704 20 residues pruned to eliminate duplicates Z: 20 33.219 2.360 0.333 0.850 1.000 0.737 CA 1.795 20 residues pruned to eliminate duplicates Z: 25 88.911 2.671 1.570 0.916 0.958 0.542 CB 1.948 25 residues pruned to eliminate duplicates Z: 28 25.919 2.409 0.557 0.401 0.926 0.667 CB 1.594 28 residues pruned to eliminate duplicates Z: 32 32.426 2.354 0.504 0.613 0.903 0.742 CB 1.635 32 residues pruned to eliminate duplicates Z: 64 50.674 2.560 0.594 0.483 0.905 0.603 CB 1.759 64 residues pruned to eliminate duplicates Z: 27 25.596 2.414 0.387 0.585 0.846 0.615 CA 1.633 27 residues pruned to eliminate duplicates Z: 13 21.415 1.997 0.633 0.801 1.000 0.417 CA 1.457 13 residues pruned to eliminate duplicates Z: 7 16.043 2.568 0.318 0.798 1.000 0.500 CA 1.491 7 residues pruned to eliminate duplicates Z: 20 50.618 2.455 1.197 0.898 0.947 0.789 CA 1.626 20 residues pruned to eliminate duplicates Z: 26 77.948 2.621 1.321 0.923 1.000 0.600 CA 1.801 26 residues pruned to eliminate duplicates Z: 20 41.625 2.388 0.864 0.901 1.000 0.789 CA 1.531 20 residues pruned to eliminate duplicates Z: 7 21.946 2.386 0.703 0.820 1.000 0.833 CB 1.670 Z: 134 78.722 2.547 0.716 0.504 0.902 0.624 CB 1.724 186 residues pruned to eliminate duplicates Z: 12 28.726 2.183 0.540 0.874 1.000 0.818 CA 1.876 12 residues pruned to eliminate duplicates Z: 17 55.150 2.572 1.290 0.905 1.000 0.500 CB 1.667 17 residues pruned to eliminate duplicates Z: 10 15.647 2.248 1.047 0.747 0.556 0.444 CA 1.636 10 residues pruned to eliminate duplicates Z: 10 25.537 2.021 1.178 0.821 1.000 0.778 CA 1.464 10 residues pruned to eliminate duplicates Z: 26 50.624 2.540 0.923 0.677 0.880 0.680 CA 2.001 26 residues pruned to eliminate duplicates Z: 9 11.339 2.370 0.426 0.659 0.875 0.625 CA 1.170 9 residues pruned to eliminate duplicates Z: 9 29.995 2.426 0.747 0.854 1.000 0.375 CA 1.848 9 residues pruned to eliminate duplicates Z: 16 23.917 2.131 0.382 0.832 1.000 0.867 CA 1.574 16 residues pruned to eliminate duplicates Z: 24 53.222 2.665 0.855 0.921 0.957 0.522 CA 1.651 24 residues pruned to eliminate duplicates Z: 36 40.604 2.417 0.681 0.508 0.943 0.629 CB 1.777 36 residues pruned to eliminate duplicates Z: 9 20.044 2.350 0.352 0.810 1.000 0.875 CA 1.703 9 residues pruned to eliminate duplicates Z: 23 34.210 2.526 0.598 0.905 0.955 0.818 CA 1.348 23 residues pruned to eliminate duplicates Z: 27 44.615 2.509 0.908 0.849 0.962 0.808 CA 1.409 27 residues pruned to eliminate duplicates Z: 135 98.606 2.594 0.823 0.580 0.940 0.634 CB 1.773 135 residues pruned to eliminate duplicates Z: 18 53.507 2.630 1.081 0.953 0.941 0.647 CA 1.733 18 residues pruned to eliminate duplicates Z: 69 96.142 2.751 1.072 0.643 0.926 0.618 CA 1.931 69 residues pruned to eliminate duplicates Z: 24 82.639 2.811 1.518 0.944 0.957 0.478 CA 1.763 24 residues pruned to eliminate duplicates Z: 22 44.045 2.290 0.923 0.871 0.952 0.714 CB 1.671 22 residues pruned to eliminate duplicates Z: 24 53.037 2.773 1.042 0.914 0.913 0.783 CA 1.512 24 residues pruned to eliminate duplicates Z: 21 50.450 2.442 1.060 0.897 0.950 0.850 CB 1.690 22 residues pruned to eliminate duplicates Z: 10 21.999 2.069 0.813 0.845 0.889 0.333 CA 1.636 13 residues pruned to eliminate duplicates Z: 105 59.899 2.453 0.622 0.435 0.904 0.625 CB 1.748 101 residues pruned to eliminate duplicates Z: 11 17.256 2.143 0.820 0.695 0.900 0.700 CB 1.301 11 residues pruned to eliminate duplicates Z: 11 14.327 1.605 0.818 0.889 0.900 0.900 CA 1.243 Z: 28 64.104 2.500 1.077 0.906 1.000 0.704 CA 1.689 28 residues pruned to eliminate duplicates Z: 10 20.956 2.054 0.765 0.863 1.000 0.778 CA 1.414 10 residues pruned to eliminate duplicates Z: 24 55.755 2.686 0.843 0.905 0.957 0.565 CA 1.748 24 residues pruned to eliminate duplicates Z: 19 39.615 2.283 0.756 0.858 1.000 0.833 CA 1.715 19 residues pruned to eliminate duplicates Z: 30 39.200 2.671 0.830 0.433 0.828 0.517 CB 1.928 30 residues pruned to eliminate duplicates Z: 27 22.345 2.015 0.560 0.604 0.962 0.731 CB 1.313 26 residues pruned to eliminate duplicates Z: 20 34.909 2.477 0.800 0.825 1.000 0.737 CA 1.356 20 residues pruned to eliminate duplicates Z: 45 73.701 2.652 1.230 0.685 0.864 0.545 CA 1.835 45 residues pruned to eliminate duplicates Z: 8 14.800 2.186 0.474 0.835 0.857 0.571 N 1.518 8 residues pruned to eliminate duplicates Z: 24 42.319 2.161 1.072 0.900 1.000 0.696 CB 1.407 22 residues pruned to eliminate duplicates Z: 20 44.456 2.437 1.244 0.886 0.947 0.579 CA 1.421 Z: 150 78.732 2.549 0.673 0.492 0.913 0.584 CB 1.672 150 residues pruned to eliminate duplicates Z: 19 40.363 2.745 1.002 0.482 0.889 0.556 CB 1.984 19 residues pruned to eliminate duplicates Z: 6 10.717 2.353 0.192 0.842 1.000 1.000 CB 1.273 Z: 13 24.365 2.350 0.463 0.836 0.833 0.667 CB 1.837 13 residues pruned to eliminate duplicates Z: 163 120.576 2.638 0.912 0.614 0.920 0.599 CB 1.833 163 residues pruned to eliminate duplicates Z: 20 35.610 2.327 0.479 0.872 1.000 0.737 CA 1.731 20 residues pruned to eliminate duplicates Z: 24 63.456 2.771 1.247 0.917 0.913 0.478 CA 1.642 24 residues pruned to eliminate duplicates Z: 22 49.692 2.276 1.262 0.873 0.952 0.524 CA 1.611 22 residues pruned to eliminate duplicates Z: 7 11.724 2.065 0.567 0.810 0.833 0.833 N 1.355 7 residues pruned to eliminate duplicates Z: 11 19.934 2.506 0.836 0.591 0.900 0.700 CB 1.395 11 residues pruned to eliminate duplicates Z: 25 57.642 2.695 1.379 0.861 0.792 0.458 CA 1.703 25 residues pruned to eliminate duplicates Z: 6 7.302 2.121 0.905 0.526 0.600 0.600 CB 1.313 Z: 77 72.334 2.727 0.547 0.579 0.908 0.711 CB 2.008 77 residues pruned to eliminate duplicates Z: 11 8.296 1.935 0.306 0.521 0.800 0.700 CB 1.271 Z: 11 25.893 2.544 0.089 0.895 1.000 0.900 CA 2.119 11 residues pruned to eliminate duplicates Z: 6 22.483 2.398 0.931 0.780 1.000 1.000 CA 1.696 6 residues pruned to eliminate duplicates Z: 19 37.605 2.337 0.549 0.911 1.000 0.889 CB 1.735 19 residues pruned to eliminate duplicates Z: 9 10.945 2.234 0.218 0.791 0.750 0.500 CA 1.469 9 residues pruned to eliminate duplicates Z: 31 33.804 2.317 0.521 0.615 0.900 0.567 CA 1.745 26 residues pruned to eliminate duplicates Z: 9 23.728 2.415 0.968 0.849 1.000 0.625 CA 1.309 9 residues pruned to eliminate duplicates Z: 20 44.303 2.614 1.033 0.769 0.947 0.789 CA 1.590 20 residues pruned to eliminate duplicates Z: 20 46.070 2.394 1.033 0.868 0.947 0.789 CA 1.675 20 residues pruned to eliminate duplicates Z: 11 10.138 1.966 0.654 0.792 0.900 0.700 CB 0.848 Z: 6 7.378 1.840 0.330 0.804 1.000 1.000 CA 1.034 6 residues pruned to eliminate duplicates Z: 23 41.324 2.255 1.220 0.873 0.909 0.318 CB 1.410 16 residues pruned to eliminate duplicates Z: 160 117.710 2.626 0.945 0.615 0.893 0.560 CB 1.835 160 residues pruned to eliminate duplicates Z: 67 51.343 2.441 0.658 0.521 0.909 0.591 CB 1.682 67 residues pruned to eliminate duplicates Z: 13 26.125 2.286 0.555 0.890 0.917 0.667 N 1.665 13 residues pruned to eliminate duplicates Z: 69 44.398 2.449 0.550 0.503 0.941 0.632 CB 1.503 69 residues pruned to eliminate duplicates Z: 13 23.058 2.022 0.546 0.898 1.000 0.917 CA 1.523 13 residues pruned to eliminate duplicates Z: 35 12.015 2.034 0.347 0.287 0.676 0.324 CB 1.414 35 residues pruned to eliminate duplicates Z: 18 68.496 2.750 1.555 0.914 1.000 0.647 CA 1.672 18 residues pruned to eliminate duplicates Z: 8 10.283 2.076 0.611 0.745 0.571 0.143 CA 1.634 8 residues pruned to eliminate duplicates Z: 20 38.503 2.525 0.770 0.887 1.000 0.842 CA 1.425 20 residues pruned to eliminate duplicates Z: 12 20.989 2.234 0.112 0.859 1.000 0.818 CB 1.875 12 residues pruned to eliminate duplicates Z: 78 45.923 2.451 0.549 0.429 0.883 0.636 CB 1.680 78 residues pruned to eliminate duplicates Z: 11 15.248 2.254 0.430 0.482 0.900 0.600 CB 1.694 Z: 42 46.725 2.516 0.655 0.569 0.902 0.610 CA 1.816 42 residues pruned to eliminate duplicates Z: 20 38.000 2.368 0.668 0.909 1.000 0.947 CB 1.566 20 residues pruned to eliminate duplicates Z: 8 19.845 2.291 0.575 0.848 0.857 0.714 CA 1.799 8 residues pruned to eliminate duplicates Z: 70 49.430 2.406 0.752 0.528 0.928 0.623 CB 1.480 70 residues pruned to eliminate duplicates Z: 19 46.801 2.608 0.936 0.877 1.000 0.556 CA 1.587 19 residues pruned to eliminate duplicates Z: 19 37.646 2.420 0.496 0.901 1.000 0.889 CA 1.749 19 residues pruned to eliminate duplicates Z: 18 27.336 2.308 0.464 0.930 1.000 0.941 CA 1.373 Z: 25 55.062 2.733 0.969 0.876 0.875 0.750 CA 1.735 25 residues pruned to eliminate duplicates Z: 100 58.284 2.538 0.643 0.408 0.879 0.596 CB 1.762 100 residues pruned to eliminate duplicates Z: 14 17.703 2.534 0.302 0.380 0.923 0.615 CB 1.833 14 residues pruned to eliminate duplicates Z: 19 49.920 2.654 1.040 0.918 0.944 0.556 CA 1.623 19 residues pruned to eliminate duplicates Z: 28 52.620 2.580 0.991 0.865 0.926 0.852 CA 1.559 28 residues pruned to eliminate duplicates Z: 42 46.525 2.577 0.620 0.542 0.878 0.585 CB 1.902 42 residues pruned to eliminate duplicates Z: 17 54.864 2.674 1.069 0.936 0.938 0.688 CA 1.842 17 residues pruned to eliminate duplicates Z: 20 33.063 2.413 0.620 0.854 0.947 0.789 CA 1.512 20 residues pruned to eliminate duplicates Z: 9 11.279 2.175 0.811 0.560 0.750 0.625 CB 1.274 Z: 8 15.746 2.262 0.216 0.792 1.000 1.000 CB 1.675 8 residues pruned to eliminate duplicates Z: 7 7.111 2.131 0.479 0.495 0.667 0.667 CA 1.388 7 residues pruned to eliminate duplicates Z: 11 21.449 2.150 0.898 0.822 0.800 0.700 CB 1.572 11 residues pruned to eliminate duplicates 7 1.376 1.752 0.466 0.234 0.500 0.333 CB 0.595 ? Z: 94 87.602 2.670 0.941 0.599 0.871 0.548 CB 1.832 94 residues pruned to eliminate duplicates Z: 91 80.657 2.591 0.986 0.622 0.878 0.544 CB 1.677 91 residues pruned to eliminate duplicates Z: 99 58.578 2.500 0.526 0.423 0.949 0.531 CB 1.770 99 residues pruned to eliminate duplicates Z: 157 85.944 2.558 0.718 0.521 0.910 0.641 CB 1.685 157 residues pruned to eliminate duplicates Z: 32 17.390 1.894 0.457 0.578 0.871 0.613 CB 1.206 14 residues pruned to eliminate duplicates Z: 6 3.315 1.875 0.481 0.288 1.000 0.400 CB 0.677 Z: 74 60.122 2.493 0.842 0.557 0.849 0.438 CB 1.707 74 residues pruned to eliminate duplicates Z: 14 25.844 2.217 0.647 0.789 1.000 0.692 CB 1.523 14 residues pruned to eliminate duplicates Z: 12 26.713 2.144 0.465 0.854 1.000 0.727 CA 1.894 12 residues pruned to eliminate duplicates Z: 26 68.642 2.696 1.054 0.888 1.000 0.640 CA 1.786 26 residues pruned to eliminate duplicates Z: 17 27.805 2.334 0.352 0.914 1.000 0.938 CA 1.559 17 residues pruned to eliminate duplicates Z: 10 15.081 2.075 0.277 0.749 1.000 0.778 CB 1.519 10 residues pruned to eliminate duplicates Z: 73 56.981 2.487 0.678 0.582 0.931 0.625 CB 1.598 73 residues pruned to eliminate duplicates Z: 8 19.745 2.382 0.930 0.540 0.857 0.571 CA 1.821 8 residues pruned to eliminate duplicates Z: 76 36.452 2.206 0.581 0.419 0.920 0.533 CB 1.427 54 residues pruned to eliminate duplicates Z: 21 35.470 2.405 0.726 0.866 1.000 0.800 CA 1.399 21 residues pruned to eliminate duplicates Z: 40 35.483 2.341 0.464 0.589 0.923 0.692 CB 1.650 40 residues pruned to eliminate duplicates Z: 102 52.516 2.406 0.611 0.495 0.861 0.525 CB 1.572 102 residues pruned to eliminate duplicates Z: 75 55.027 2.416 0.770 0.529 0.878 0.595 CB 1.655 75 residues pruned to eliminate duplicates Z: 77 53.525 2.533 0.525 0.479 0.934 0.553 CB 1.738 77 residues pruned to eliminate duplicates Z: 19 28.416 2.308 0.616 0.896 0.944 0.833 CA 1.362 19 residues pruned to eliminate duplicates Z: 19 41.753 2.542 0.821 0.946 1.000 1.000 CA 1.471 19 residues pruned to eliminate duplicates Z: 10 12.545 2.022 0.743 0.657 0.889 0.667 CB 1.154 10 residues pruned to eliminate duplicates Z: 18 31.218 2.386 0.382 0.855 0.941 0.824 CA 1.800 18 residues pruned to eliminate duplicates Z: 72 80.577 2.673 1.053 0.586 0.887 0.549 CA 1.809 72 residues pruned to eliminate duplicates Z: 13 8.696 2.007 0.478 0.295 0.750 0.583 N 1.419 Z: 13 21.899 2.309 0.348 0.865 0.833 0.750 N 1.786 13 residues pruned to eliminate duplicates Z: 18 35.133 2.225 0.716 0.902 0.941 0.765 CA 1.691 18 residues pruned to eliminate duplicates Z: 63 43.495 2.465 0.532 0.514 0.935 0.581 CB 1.542 63 residues pruned to eliminate duplicates Z: 6 6.899 1.390 1.549 0.561 0.800 0.400 CB 1.026 Z: 8 19.400 2.287 0.455 0.823 1.000 0.857 CB 1.665 Z: 71 40.978 2.179 0.747 0.469 0.914 0.614 CB 1.453 33 residues pruned to eliminate duplicates Z: 8 22.062 2.579 0.695 0.830 0.857 0.714 CA 1.673 8 residues pruned to eliminate duplicates Z: 38 27.933 2.420 0.437 0.467 0.946 0.649 CB 1.444 38 residues pruned to eliminate duplicates Z: 10 29.504 2.295 0.885 0.868 0.889 0.556 CB 1.870 10 residues pruned to eliminate duplicates Z: 13 21.412 2.594 0.485 0.500 0.917 0.583 CA 1.751 13 residues pruned to eliminate duplicates Z: 20 45.491 2.253 0.911 0.921 1.000 0.789 CB 1.705 20 residues pruned to eliminate duplicates Z: 121 77.456 2.505 0.719 0.473 0.933 0.633 CA 1.808 124 residues pruned to eliminate duplicates Z: 25 36.818 2.763 0.587 0.892 0.917 0.750 CA 1.343 25 residues pruned to eliminate duplicates Z: 145 73.367 2.512 0.586 0.500 0.917 0.660 CB 1.675 145 residues pruned to eliminate duplicates Z: 60 65.003 2.580 1.017 0.643 0.864 0.424 CB 1.646 61 residues pruned to eliminate duplicates Z: 25 72.881 2.734 1.157 0.889 0.958 0.458 CA 1.895 25 residues pruned to eliminate duplicates Z: 11 10.160 2.274 0.378 0.387 0.700 0.700 CA 1.650 11 residues pruned to eliminate duplicates Z: 64 43.282 2.468 0.543 0.435 0.921 0.540 CB 1.664 64 residues pruned to eliminate duplicates Z: 23 32.968 2.172 0.509 0.903 1.000 0.955 CA 1.528 23 residues pruned to eliminate duplicates Z: 8 19.094 2.263 0.696 0.716 0.857 0.571 CA 1.804 8 residues pruned to eliminate duplicates Z: 19 41.045 2.430 0.717 0.891 1.000 0.778 CA 1.667 19 residues pruned to eliminate duplicates Z: 7 8.499 2.440 0.049 0.872 0.667 0.333 CB 1.482 7 residues pruned to eliminate duplicates Z: 23 34.209 2.069 0.687 0.869 1.000 0.818 CA 1.527 23 residues pruned to eliminate duplicates Z: 19 36.350 2.407 0.499 0.882 0.889 0.667 CB 1.935 19 residues pruned to eliminate duplicates Z: 10 15.004 2.096 0.486 0.798 0.889 0.556 N 1.392 10 residues pruned to eliminate duplicates Z: 8 13.152 2.396 0.573 0.830 1.000 0.714 CA 0.991 8 residues pruned to eliminate duplicates Z: 82 44.541 2.422 0.430 0.431 0.926 0.580 CB 1.657 82 residues pruned to eliminate duplicates Z: 19 36.603 2.468 0.567 0.862 1.000 0.944 CB 1.638 19 residues pruned to eliminate duplicates Z: 19 38.251 2.463 0.644 0.894 0.944 0.944 CA 1.691 19 residues pruned to eliminate duplicates Z: 9 17.899 2.204 0.387 0.712 1.000 0.750 N 1.708 9 residues pruned to eliminate duplicates Z: 24 42.599 2.220 0.992 0.921 0.957 0.565 CA 1.478 25 residues pruned to eliminate duplicates Z: 12 12.975 2.301 0.247 0.630 0.909 0.636 CB 1.327 12 residues pruned to eliminate duplicates Z: 19 41.900 2.186 1.348 0.908 0.889 0.611 CB 1.537 19 residues pruned to eliminate duplicates Z: 24 60.205 2.616 1.326 0.879 0.957 0.522 CA 1.564 24 residues pruned to eliminate duplicates Z: 24 23.417 2.476 0.524 0.377 0.870 0.565 CB 1.696 24 residues pruned to eliminate duplicates Z: 12 27.068 2.446 1.204 0.862 0.818 0.364 CA 1.359 12 residues pruned to eliminate duplicates Z: 21 37.361 2.214 0.674 0.907 1.000 0.950 CB 1.602 21 residues pruned to eliminate duplicates Z: 7 4.651 1.954 0.307 0.248 0.667 0.667 CB 1.491 Z: 50 43.058 2.523 0.576 0.551 0.898 0.531 CB 1.640 50 residues pruned to eliminate duplicates Z: 25 48.560 2.708 1.082 0.764 0.917 0.542 CA 1.517 25 residues pruned to eliminate duplicates Z: 9 30.481 2.195 1.365 0.716 1.000 0.750 CB 1.708 9 residues pruned to eliminate duplicates Z: 147 99.749 2.625 0.808 0.592 0.884 0.630 CB 1.802 147 residues pruned to eliminate duplicates Z: 126 88.445 2.523 0.826 0.584 0.904 0.632 CB 1.752 126 residues pruned to eliminate duplicates Z: 7 12.206 2.435 0.248 0.472 1.000 0.333 CB 1.686 7 residues pruned to eliminate duplicates Z: 60 78.477 2.643 1.062 0.673 0.932 0.644 CB 1.715 60 residues pruned to eliminate duplicates Z: 19 24.357 2.064 0.555 0.916 0.944 0.667 CA 1.338 19 residues pruned to eliminate duplicates Z: 10 11.171 2.131 0.776 0.527 0.778 0.444 CB 1.232 15 residues pruned to eliminate duplicates Z: 12 26.864 2.319 0.522 0.860 1.000 0.818 CB 1.687 12 residues pruned to eliminate duplicates Z: 18 32.489 2.198 0.654 0.861 1.000 0.824 CA 1.593 18 residues pruned to eliminate duplicates Z: 43 29.617 2.397 0.735 0.327 0.833 0.476 CB 1.595 43 residues pruned to eliminate duplicates Z: 9 14.028 2.190 0.296 0.717 0.875 0.875 CB 1.640 9 residues pruned to eliminate duplicates Z: 22 36.171 2.151 0.757 0.805 0.952 0.667 CA 1.681 22 residues pruned to eliminate duplicates Z: 20 34.635 2.212 0.673 0.891 1.000 0.842 CB 1.543 20 residues pruned to eliminate duplicates Z: 26 81.868 2.689 1.320 0.933 1.000 0.560 CA 1.831 26 residues pruned to eliminate duplicates Z: 8 9.818 2.158 0.508 0.509 0.857 0.571 CB 1.318 8 residues pruned to eliminate duplicates Z: 38 21.959 2.286 0.356 0.479 0.838 0.703 CB 1.420 38 residues pruned to eliminate duplicates Z: 19 43.353 2.512 0.778 0.888 1.000 0.778 CA 1.649 19 residues pruned to eliminate duplicates Z: 18 39.754 2.574 0.509 0.932 1.000 0.941 CA 1.734 18 residues pruned to eliminate duplicates Z: 14 12.021 2.250 0.725 0.366 0.846 0.385 CB 1.172 14 residues pruned to eliminate duplicates Z: 28 27.048 2.527 0.389 0.485 0.926 0.593 CB 1.627 28 residues pruned to eliminate duplicates Z: 24 61.586 2.759 1.223 0.921 0.913 0.435 CA 1.613 24 residues pruned to eliminate duplicates Z: 6 3.484 1.341 0.503 0.846 0.800 0.600 CB 0.718 6 residues pruned to eliminate duplicates Z: 20 41.398 2.250 0.796 0.907 1.000 0.684 CA 1.670 20 residues pruned to eliminate duplicates Z: 237 126.437 2.569 0.848 0.582 0.915 0.657 CA 1.750 224 residues pruned to eliminate duplicates Z: 7 12.685 2.463 0.014 0.771 1.000 0.667 CB 1.631 7 residues pruned to eliminate duplicates Z: 26 55.570 2.488 1.247 0.913 0.920 0.320 CA 1.529 26 residues pruned to eliminate duplicates Z: 13 22.577 2.140 0.605 0.872 1.000 0.917 CB 1.383 13 residues pruned to eliminate duplicates Z: 20 45.433 2.531 1.019 0.908 0.947 0.737 CA 1.530 20 residues pruned to eliminate duplicates Z: 6 3.502 2.020 -0.184 0.437 0.800 0.600 CB 1.267 Z: 7 14.892 2.146 0.498 0.765 1.000 0.667 N 1.494 7 residues pruned to eliminate duplicates Z: 20 49.555 2.441 1.233 0.894 0.947 0.684 CA 1.580 20 residues pruned to eliminate duplicates Z: 9 21.844 2.228 0.889 0.827 0.875 0.750 CB 1.580 9 residues pruned to eliminate duplicates Z: 7 5.352 1.916 0.418 0.805 1.000 1.000 CB 0.616 Z: 19 17.576 2.356 0.384 0.427 0.944 0.500 CB 1.452 11 residues pruned to eliminate duplicates Z: 19 33.266 2.352 0.915 0.876 0.833 0.611 CB 1.518 19 residues pruned to eliminate duplicates Z: 30 47.764 2.527 0.770 0.779 0.966 0.724 CA 1.606 30 residues pruned to eliminate duplicates Z: 128 83.673 2.515 0.779 0.588 0.890 0.567 CB 1.715 128 residues pruned to eliminate duplicates Z: 27 79.233 2.572 1.498 0.899 0.923 0.538 CA 1.873 27 residues pruned to eliminate duplicates Z: 58 54.488 2.506 0.761 0.557 0.877 0.649 CB 1.763 50 residues pruned to eliminate duplicates Z: 7 15.692 2.080 1.223 0.720 0.833 0.500 CB 1.363 7 residues pruned to eliminate duplicates Z: 10 22.692 2.193 1.188 0.796 0.778 0.667 CA 1.565 10 residues pruned to eliminate duplicates Z: 76 45.898 2.492 0.640 0.412 0.880 0.533 CB 1.617 76 residues pruned to eliminate duplicates Z: 11 41.076 2.503 1.278 0.916 1.000 0.700 CB 1.609 11 residues pruned to eliminate duplicates Z: 19 29.169 2.108 0.457 0.867 1.000 0.833 CA 1.637 19 residues pruned to eliminate duplicates Z: 20 35.770 2.245 1.113 0.882 0.895 0.526 CB 1.400 20 residues pruned to eliminate duplicates Z: 12 27.116 2.437 0.823 0.834 0.909 0.727 CA 1.518 12 residues pruned to eliminate duplicates Z: 12 20.351 2.331 0.323 0.885 1.000 0.818 CA 1.437 12 residues pruned to eliminate duplicates Z: 9 26.951 2.386 0.993 0.690 0.875 0.750 N 1.924 9 residues pruned to eliminate duplicates Z: 105 70.369 2.554 0.650 0.525 0.875 0.654 CB 1.827 105 residues pruned to eliminate duplicates Z: 7 15.892 2.199 0.407 0.833 1.000 0.500 CA 1.573 7 residues pruned to eliminate duplicates Z: 22 39.603 2.221 0.953 0.891 0.952 0.667 CB 1.504 22 residues pruned to eliminate duplicates Z: 8 8.995 2.096 0.989 0.364 0.571 0.286 CB 1.652 Z: 9 21.470 2.223 0.551 0.830 1.000 0.750 CB 1.654 9 residues pruned to eliminate duplicates Z: 283 132.604 2.587 0.787 0.551 0.908 0.592 CB 1.792 315 residues pruned to eliminate duplicates Z: 17 32.157 2.282 0.751 0.906 0.938 0.562 CA 1.526 17 residues pruned to eliminate duplicates Z: 10 5.821 2.189 0.394 0.501 0.778 0.444 CB 0.817 Z: 16 41.791 2.377 1.035 0.952 1.000 0.800 CA 1.537 16 residues pruned to eliminate duplicates Z: 7 19.594 2.441 0.627 0.868 1.000 0.833 CA 1.472 7 residues pruned to eliminate duplicates Z: 9 8.146 2.139 0.888 0.372 0.625 0.500 CA 1.309 Z: 61 53.104 2.580 0.492 0.555 0.967 0.700 CB 1.746 61 residues pruned to eliminate duplicates Z: 10 23.668 2.239 0.687 0.803 0.889 0.556 N 1.804 10 residues pruned to eliminate duplicates Z: 15 10.139 2.114 0.281 0.476 0.857 0.571 CB 1.197 15 residues pruned to eliminate duplicates Z: 8 15.682 2.417 0.348 0.731 0.857 0.429 CA 1.724 8 residues pruned to eliminate duplicates Z: 114 64.234 2.474 0.586 0.528 0.920 0.584 CB 1.628 114 residues pruned to eliminate duplicates Z: 27 72.411 2.641 1.238 0.926 1.000 0.769 CA 1.686 27 residues pruned to eliminate duplicates Z: 8 15.231 2.352 0.245 0.871 0.857 0.857 CA 1.673 8 residues pruned to eliminate duplicates Z: 88 75.253 2.671 0.673 0.537 0.931 0.598 CB 1.870 88 residues pruned to eliminate duplicates Z: 10 13.288 1.965 0.875 0.830 0.778 0.556 CA 1.162 Z: 14 26.815 2.033 0.622 0.887 1.000 0.692 CB 1.627 14 residues pruned to eliminate duplicates Z: 19 37.874 2.250 0.976 0.916 1.000 0.667 CB 1.418 19 residues pruned to eliminate duplicates Z: 59 37.385 2.428 0.443 0.463 0.948 0.655 CB 1.534 59 residues pruned to eliminate duplicates Z: 96 61.159 2.563 0.638 0.445 0.916 0.663 CB 1.728 96 residues pruned to eliminate duplicates Z: 7 5.788 2.149 0.473 0.396 0.500 0.167 N 1.667 Z: 9 20.719 2.366 0.424 0.765 1.000 0.750 CA 1.719 9 residues pruned to eliminate duplicates Z: 18 43.394 2.508 0.797 0.935 1.000 0.941 CB 1.627 18 residues pruned to eliminate duplicates Z: 19 27.337 2.139 0.421 0.866 0.944 0.722 CA 1.643 19 residues pruned to eliminate duplicates Z: 19 46.570 2.393 1.112 0.933 1.000 0.778 CB 1.515 19 residues pruned to eliminate duplicates Z: 10 8.123 2.101 0.514 0.393 0.667 0.444 CB 1.431 Z: 12 26.633 2.266 0.931 0.892 0.909 0.636 CA 1.450 Z: 192 115.276 2.612 0.856 0.547 0.932 0.628 CA 1.764 187 residues pruned to eliminate duplicates Z: 26 21.032 2.244 0.710 0.507 0.880 0.480 CB 1.237 26 residues pruned to eliminate duplicates Z: 7 18.293 2.412 1.207 0.757 0.833 0.500 CB 1.340 7 residues pruned to eliminate duplicates Z: 9 21.925 2.473 0.662 0.855 0.875 0.750 CA 1.590 9 residues pruned to eliminate duplicates Z: 6 6.499 2.172 0.213 0.723 0.600 0.400 CB 1.503 6 residues pruned to eliminate duplicates Z: 55 38.405 2.373 0.607 0.416 0.944 0.537 CB 1.584 55 residues pruned to eliminate duplicates Z: 46 48.970 2.547 0.693 0.537 0.889 0.667 CB 1.836 46 residues pruned to eliminate duplicates Z: 20 42.543 2.302 1.006 0.872 0.947 0.684 CB 1.627 20 residues pruned to eliminate duplicates Z: 19 27.009 2.068 0.630 0.916 0.944 0.889 CA 1.412 19 residues pruned to eliminate duplicates Z: 21 41.872 2.300 0.832 0.938 1.000 0.800 CA 1.545 21 residues pruned to eliminate duplicates Z: 31 36.169 2.504 0.813 0.608 0.833 0.567 CA 1.575 31 residues pruned to eliminate duplicates Z: 72 53.465 2.529 0.587 0.509 0.930 0.634 CB 1.686 93 residues pruned to eliminate duplicates Z: 18 41.783 2.310 1.161 0.830 0.941 0.647 CB 1.621 18 residues pruned to eliminate duplicates Z: 19 24.011 2.267 0.243 0.905 1.000 0.833 CA 1.429 Z: 21 30.771 2.161 0.451 0.905 1.000 0.850 CB 1.563 21 residues pruned to eliminate duplicates Z: 17 33.668 2.189 0.895 0.843 1.000 0.688 CA 1.511 17 residues pruned to eliminate duplicates Z: 30 64.092 2.629 1.211 0.813 0.966 0.517 CA 1.616 30 residues pruned to eliminate duplicates Z: 11 33.271 2.062 1.247 0.896 1.000 1.000 CA 1.627 11 residues pruned to eliminate duplicates Z: 7 8.751 1.556 0.981 0.697 0.833 0.667 CA 1.161 Z: 25 42.796 2.688 0.746 0.867 1.000 0.750 CA 1.362 25 residues pruned to eliminate duplicates Z: 36 27.628 2.385 0.486 0.433 0.829 0.400 CB 1.705 38 residues pruned to eliminate duplicates Z: 9 20.479 2.369 0.542 0.741 1.000 0.500 CB 1.598 9 residues pruned to eliminate duplicates Z: 14 21.994 2.002 0.579 0.806 0.923 0.692 CB 1.602 14 residues pruned to eliminate duplicates Z: 41 18.359 2.379 0.421 0.262 0.800 0.475 CB 1.408 41 residues pruned to eliminate duplicates Z: 7 6.565 1.906 0.833 0.228 0.833 0.333 CA 1.264 Z: 13 26.200 2.297 0.453 0.875 1.000 0.667 CB 1.649 13 residues pruned to eliminate duplicates Z: 7 9.483 2.480 0.106 0.650 0.833 0.500 CB 1.473 Z: 163 97.934 2.585 0.682 0.523 0.926 0.636 CB 1.868 163 residues pruned to eliminate duplicates Z: 22 38.042 2.260 0.845 0.873 0.952 0.714 CB 1.523 22 residues pruned to eliminate duplicates Z: 20 16.300 2.103 0.517 0.460 0.842 0.421 CA 1.450 20 residues pruned to eliminate duplicates Z: 10 14.318 2.302 0.405 0.542 1.000 0.556 CB 1.416 Z: 13 5.061 1.931 0.157 0.233 0.833 0.333 CB 1.071 13 residues pruned to eliminate duplicates Z: 25 43.210 2.702 0.875 0.915 0.958 0.875 CA 1.283 25 residues pruned to eliminate duplicates Z: 19 38.724 2.255 0.687 0.906 1.000 0.944 CB 1.707 19 residues pruned to eliminate duplicates Z: 6 9.154 1.768 0.522 0.849 1.000 1.000 CA 1.128 6 residues pruned to eliminate duplicates Z: 8 18.296 2.314 0.554 0.698 1.000 0.429 CA 1.605 8 residues pruned to eliminate duplicates Z: 54 51.370 2.411 0.683 0.601 0.925 0.717 CB 1.708 54 residues pruned to eliminate duplicates Z: 20 36.139 2.190 0.745 0.925 1.000 0.895 CA 1.522 20 residues pruned to eliminate duplicates Z: 8 16.506 1.954 0.616 0.778 1.000 0.571 CB 1.546 8 residues pruned to eliminate duplicates Z: 20 35.027 2.474 0.610 0.901 1.000 0.842 CA 1.439 20 residues pruned to eliminate duplicates Z: 17 31.154 2.301 0.522 0.941 1.000 0.812 CB 1.544 18 residues pruned to eliminate duplicates Z: 21 28.424 2.191 0.339 0.902 1.000 0.850 CA 1.545 21 residues pruned to eliminate duplicates Z: 10 9.578 2.232 0.632 0.482 0.667 0.444 CB 1.339 10 residues pruned to eliminate duplicates Z: 20 34.445 2.191 0.679 0.889 1.000 0.842 CB 1.546 20 residues pruned to eliminate duplicates 7 1.779 1.635 0.497 0.261 0.667 0.500 CB 0.585 ? Z: 18 46.018 2.470 0.932 0.922 1.000 0.882 CB 1.644 18 residues pruned to eliminate duplicates Z: 9 16.903 2.011 0.393 0.821 0.875 0.750 O 1.846 9 residues pruned to eliminate duplicates Z: 18 23.782 2.499 0.510 0.653 0.765 0.647 CB 1.735 18 residues pruned to eliminate duplicates Z: 23 43.436 2.212 1.114 0.891 0.955 0.773 CB 1.491 23 residues pruned to eliminate duplicates Z: 13 28.906 2.105 0.855 0.839 0.917 0.750 CA 1.742 13 residues pruned to eliminate duplicates Z: 72 58.147 2.500 0.732 0.583 0.901 0.704 CB 1.633 72 residues pruned to eliminate duplicates Z: 19 30.531 2.441 0.570 0.859 1.000 0.778 CA 1.382 19 residues pruned to eliminate duplicates Z: 55 76.730 2.641 1.026 0.707 0.926 0.593 CB 1.746 55 residues pruned to eliminate duplicates Z: 79 41.778 2.440 0.647 0.381 0.897 0.551 CB 1.488 79 residues pruned to eliminate duplicates Z: 8 15.570 2.441 0.769 0.540 0.857 0.714 CB 1.529 8 residues pruned to eliminate duplicates Z: 17 7.780 1.956 0.182 0.357 0.875 0.312 CB 1.122 Z: 8 12.475 2.348 0.096 0.859 1.000 0.857 CB 1.348 11 residues pruned to eliminate duplicates Z: 22 43.342 2.278 0.945 0.879 1.000 0.714 CB 1.548 22 residues pruned to eliminate duplicates Z: 9 15.394 2.215 0.702 0.888 0.750 0.750 CA 1.386 9 residues pruned to eliminate duplicates Z: 24 64.796 2.798 1.208 0.907 0.913 0.565 CA 1.702 24 residues pruned to eliminate duplicates Z: 18 31.731 2.170 0.598 0.885 1.000 0.824 CA 1.603 18 residues pruned to eliminate duplicates Z: 22 38.659 2.219 0.937 0.912 0.952 0.857 CB 1.459 22 residues pruned to eliminate duplicates Z: 33 32.801 2.502 0.394 0.641 0.906 0.719 CA 1.608 33 residues pruned to eliminate duplicates Z: 6 10.125 1.748 1.200 0.700 0.800 0.800 N 1.227 6 residues pruned to eliminate duplicates Z: 7 10.668 2.156 0.066 0.796 1.000 0.667 N 1.462 7 residues pruned to eliminate duplicates Z: 13 22.630 2.342 0.299 0.853 0.917 0.583 CB 1.731 13 residues pruned to eliminate duplicates Z: 21 29.465 2.231 0.519 0.892 0.950 0.850 CA 1.470 21 residues pruned to eliminate duplicates Z: 91 51.445 2.453 0.551 0.472 0.922 0.633 CB 1.590 91 residues pruned to eliminate duplicates Z: 64 46.229 2.425 0.606 0.439 0.937 0.603 CB 1.702 64 residues pruned to eliminate duplicates Z: 6 12.155 2.480 0.835 0.675 0.800 0.600 CB 1.271 6 residues pruned to eliminate duplicates Z: 72 56.267 2.580 0.654 0.462 0.930 0.592 CB 1.749 72 residues pruned to eliminate duplicates Z: 30 43.844 2.625 0.757 0.812 0.966 0.655 CA 1.393 30 residues pruned to eliminate duplicates Z: 27 35.100 2.480 0.620 0.881 0.962 0.846 CA 1.290 27 residues pruned to eliminate duplicates Z: 53 51.442 2.507 0.636 0.491 0.962 0.577 CA 1.825 53 residues pruned to eliminate duplicates Z: 28 20.141 2.058 0.317 0.706 0.926 0.704 CB 1.280 28 residues pruned to eliminate duplicates Z: 20 44.544 2.340 0.879 0.887 1.000 0.632 CA 1.677 20 residues pruned to eliminate duplicates Z: 30 28.978 2.440 0.726 0.452 0.793 0.621 CA 1.692 30 residues pruned to eliminate duplicates Z: 20 34.148 2.309 0.538 0.866 0.895 0.789 CB 1.805 20 residues pruned to eliminate duplicates Z: 34 27.735 2.310 0.458 0.579 0.818 0.606 CB 1.623 34 residues pruned to eliminate duplicates Z: 18 40.193 2.462 0.758 0.921 0.941 0.706 CA 1.684 18 residues pruned to eliminate duplicates Z: 9 14.124 2.039 1.112 0.800 0.750 0.750 CB 1.189 8 residues pruned to eliminate duplicates Z: 8 6.967 2.283 0.513 0.516 0.857 0.571 CB 0.875 Z: 19 41.737 2.518 0.771 0.890 0.944 0.778 CA 1.681 19 residues pruned to eliminate duplicates Z: 17 54.181 2.644 1.039 0.931 1.000 0.688 CA 1.756 17 residues pruned to eliminate duplicates Z: 22 43.473 2.162 1.179 0.878 0.952 0.571 CB 1.534 22 residues pruned to eliminate duplicates Z: 9 9.061 2.364 0.420 0.591 0.750 0.500 CB 1.166 8 residues pruned to eliminate duplicates Z: 19 35.958 2.198 0.822 0.860 1.000 0.778 CB 1.557 19 residues pruned to eliminate duplicates Z: 24 39.548 2.756 0.560 0.886 0.957 0.870 CA 1.446 24 residues pruned to eliminate duplicates Z: 19 45.031 2.515 0.937 0.905 1.000 0.778 CA 1.551 19 residues pruned to eliminate duplicates Z: 11 14.909 2.051 0.695 0.812 0.700 0.500 CA 1.476 11 residues pruned to eliminate duplicates Z: 9 12.910 2.382 0.496 0.563 0.750 0.625 CA 1.607 9 residues pruned to eliminate duplicates Z: 10 16.101 2.398 0.313 0.846 0.889 0.778 CA 1.424 10 residues pruned to eliminate duplicates Z: 87 91.305 2.644 1.004 0.579 0.930 0.593 CB 1.850 87 residues pruned to eliminate duplicates Z: 49 38.481 2.530 0.597 0.498 0.917 0.583 CB 1.502 49 residues pruned to eliminate duplicates Z: 16 37.716 2.858 0.843 0.926 0.933 0.933 CA 1.389 16 residues pruned to eliminate duplicates Z: 13 24.928 2.329 0.827 0.869 0.833 0.667 CA 1.482 13 residues pruned to eliminate duplicates Z: 11 18.038 1.956 0.855 0.858 0.900 0.700 CA 1.287 11 residues pruned to eliminate duplicates Z: 26 31.725 2.171 0.578 0.928 1.000 0.840 CA 1.297 22 residues pruned to eliminate duplicates Z: 92 93.212 2.625 0.980 0.627 0.923 0.549 CB 1.807 92 residues pruned to eliminate duplicates Z: 6 7.685 1.936 0.635 0.795 0.800 0.600 CA 1.048 Z: 21 34.754 2.204 0.719 0.892 1.000 0.900 CB 1.474 22 residues pruned to eliminate duplicates Z: 17 43.233 2.465 1.146 0.900 0.938 0.688 CA 1.557 17 residues pruned to eliminate duplicates Z: 139 83.187 2.474 0.821 0.542 0.891 0.522 CB 1.693 139 residues pruned to eliminate duplicates Z: 20 37.531 2.301 0.501 0.884 1.000 0.789 CA 1.801 20 residues pruned to eliminate duplicates Z: 62 71.113 2.626 0.929 0.648 0.885 0.557 CB 1.768 62 residues pruned to eliminate duplicates Z: 19 43.703 2.588 0.695 0.897 1.000 0.722 CA 1.681 19 residues pruned to eliminate duplicates Z: 37 47.495 2.662 0.652 0.721 0.944 0.778 CA 1.561 37 residues pruned to eliminate duplicates Z: 10 20.801 2.209 0.781 0.818 0.889 0.778 CA 1.504 10 residues pruned to eliminate duplicates Z: 77 56.355 2.553 0.671 0.440 0.934 0.632 CB 1.726 77 residues pruned to eliminate duplicates Z: 15 22.340 2.102 0.768 0.829 1.000 0.786 CA 1.209 15 residues pruned to eliminate duplicates Z: 76 60.813 2.506 0.772 0.550 0.893 0.547 CB 1.685 96 residues pruned to eliminate duplicates Z: 42 46.495 2.245 1.094 0.667 0.902 0.488 CB 1.467 45 residues pruned to eliminate duplicates Z: 20 34.484 2.234 0.744 0.899 1.000 0.789 CB 1.451 20 residues pruned to eliminate duplicates Z: 11 32.054 2.318 1.190 0.863 1.000 0.600 CA 1.465 12 residues pruned to eliminate duplicates Z: 9 15.327 2.167 0.371 0.711 0.875 0.625 N 1.721 9 residues pruned to eliminate duplicates Z: 22 46.963 2.272 1.034 0.920 1.000 0.857 CB 1.561 22 residues pruned to eliminate duplicates Z: 32 33.265 2.074 0.737 0.705 0.968 0.806 CA 1.422 32 residues pruned to eliminate duplicates Z: 34 30.425 2.562 0.567 0.401 0.848 0.636 CB 1.724 34 residues pruned to eliminate duplicates Z: 11 26.915 2.374 0.989 0.772 0.900 0.800 CA 1.575 11 residues pruned to eliminate duplicates Z: 42 28.890 2.429 0.458 0.368 0.902 0.610 CB 1.626 42 residues pruned to eliminate duplicates Z: 20 39.216 2.463 0.965 0.917 0.842 0.632 CA 1.558 20 residues pruned to eliminate duplicates Z: 6 9.988 1.907 0.680 0.795 1.000 0.600 CA 1.077 6 residues pruned to eliminate duplicates Z: 6 5.755 1.546 0.951 0.704 1.000 0.800 CA 0.709 6 residues pruned to eliminate duplicates Z: 25 29.122 2.222 0.506 0.949 0.958 0.875 CA 1.280 25 residues pruned to eliminate duplicates Z: 9 17.609 2.060 0.445 0.831 1.000 0.625 CA 1.571 9 residues pruned to eliminate duplicates Z: 15 11.120 2.427 0.248 0.199 0.857 0.429 CB 1.638 15 residues pruned to eliminate duplicates Z: 10 8.437 2.012 0.550 0.559 0.889 0.667 CB 0.958 10 residues pruned to eliminate duplicates Z: 79 57.530 2.547 0.710 0.430 0.923 0.692 CB 1.741 79 residues pruned to eliminate duplicates Z: 14 24.694 2.264 0.752 0.811 0.769 0.538 N 1.713 14 residues pruned to eliminate duplicates Z: 18 20.991 2.264 0.262 0.950 1.000 0.941 CA 1.229 18 residues pruned to eliminate duplicates Z: 12 18.948 1.977 0.410 0.795 1.000 0.545 CA 1.582 12 residues pruned to eliminate duplicates Z: 10 6.282 2.021 0.377 0.327 0.667 0.444 CB 1.366 Z: 21 43.089 2.220 1.234 0.914 1.000 0.650 CB 1.374 21 residues pruned to eliminate duplicates Z: 12 27.520 2.316 1.034 0.920 0.818 0.727 CA 1.516 12 residues pruned to eliminate duplicates Z: 6 6.326 1.797 0.809 0.721 1.000 0.600 CB 0.713 6 residues pruned to eliminate duplicates Z: 13 34.478 2.451 0.966 0.942 1.000 0.583 CA 1.432 14 residues pruned to eliminate duplicates Z: 13 18.690 2.031 0.558 0.847 0.917 0.667 CA 1.381 13 residues pruned to eliminate duplicates Z: 102 58.830 2.475 0.639 0.403 0.931 0.525 CB 1.718 102 residues pruned to eliminate duplicates Z: 22 21.328 2.329 0.719 0.467 0.810 0.524 CB 1.486 22 residues pruned to eliminate duplicates Z: 62 43.086 2.611 0.584 0.434 0.869 0.590 CB 1.644 62 residues pruned to eliminate duplicates Z: 8 13.221 2.253 0.377 0.745 0.857 0.571 CA 1.509 8 residues pruned to eliminate duplicates Z: 6 8.947 2.301 0.492 0.467 0.800 0.800 CB 1.507 Z: 61 43.742 2.241 0.873 0.632 0.883 0.567 CB 1.345 59 residues pruned to eliminate duplicates Z: 18 43.729 2.514 0.741 0.923 1.000 0.824 CA 1.702 18 residues pruned to eliminate duplicates Z: 9 12.888 2.092 0.330 0.865 0.875 0.875 CA 1.372 9 residues pruned to eliminate duplicates Z: 71 81.671 2.717 1.036 0.592 0.886 0.571 CA 1.825 71 residues pruned to eliminate duplicates Z: 6 4.652 1.896 0.381 0.427 0.800 0.600 CB 1.072 Z: 18 38.662 2.521 0.672 0.905 0.941 0.647 CB 1.682 18 residues pruned to eliminate duplicates Z: 13 19.117 2.176 0.551 0.931 1.000 0.917 CA 1.143 13 residues pruned to eliminate duplicates Z: 9 18.044 2.214 0.936 0.570 0.875 0.500 N 1.589 9 residues pruned to eliminate duplicates Z: 46 45.850 2.522 0.599 0.529 0.911 0.600 CB 1.807 46 residues pruned to eliminate duplicates Z: 8 15.667 2.061 1.046 0.827 0.857 0.571 CA 1.234 8 residues pruned to eliminate duplicates Z: 73 56.771 2.477 0.755 0.584 0.889 0.708 CB 1.598 73 residues pruned to eliminate duplicates Z: 59 47.408 2.601 0.462 0.517 0.914 0.586 CB 1.762 59 residues pruned to eliminate duplicates Z: 12 17.302 2.437 0.343 0.850 0.818 0.818 CA 1.442 12 residues pruned to eliminate duplicates Z: 8 9.914 2.175 -0.097 0.585 1.000 0.429 N 1.759 Z: 23 32.153 2.228 0.881 0.719 0.909 0.727 CB 1.476 23 residues pruned to eliminate duplicates Z: 18 34.637 2.292 1.010 0.876 0.941 0.647 CB 1.408 18 residues pruned to eliminate duplicates Z: 8 17.840 2.388 0.333 0.861 0.857 0.714 CB 1.816 8 residues pruned to eliminate duplicates Z: 45 27.797 2.276 0.453 0.464 0.886 0.523 CB 1.483 45 residues pruned to eliminate duplicates Z: 160 92.464 2.556 0.715 0.509 0.912 0.610 CA 1.818 160 residues pruned to eliminate duplicates Z: 7 14.816 2.441 0.272 0.855 1.000 1.000 CB 1.437 7 residues pruned to eliminate duplicates Z: 12 28.231 2.390 0.375 0.880 1.000 0.636 CA 1.878 12 residues pruned to eliminate duplicates Z: 27 54.148 2.231 1.217 0.927 0.962 0.654 CA 1.564 27 residues pruned to eliminate duplicates Z: 19 34.552 2.207 0.791 0.943 1.000 0.500 CB 1.427 18 residues pruned to eliminate duplicates Z: 6 2.983 1.860 0.089 0.275 0.600 0.600 CB 1.416 Z: 77 90.185 2.691 1.049 0.602 0.895 0.539 CB 1.903 77 residues pruned to eliminate duplicates Z: 6 9.136 1.941 0.619 0.718 0.800 0.800 N 1.335 6 residues pruned to eliminate duplicates Z: 21 31.483 2.028 0.879 0.779 0.950 0.700 CA 1.520 21 residues pruned to eliminate duplicates Z: 19 31.479 2.364 0.644 0.828 0.944 0.778 CA 1.521 19 residues pruned to eliminate duplicates Z: 20 31.593 2.344 0.459 0.880 0.895 0.684 CB 1.716 20 residues pruned to eliminate duplicates Z: 24 46.129 2.327 1.153 0.892 0.913 0.522 CB 1.510 24 residues pruned to eliminate duplicates Z: 9 11.642 2.264 0.482 0.818 0.625 0.625 CA 1.489 9 residues pruned to eliminate duplicates Z: 21 38.206 2.266 0.828 0.921 0.950 0.800 CB 1.527 21 residues pruned to eliminate duplicates Z: 9 17.109 2.197 0.700 0.824 0.750 0.750 CA 1.631 9 residues pruned to eliminate duplicates Z: 59 65.214 2.621 0.886 0.653 0.845 0.621 CA 1.778 59 residues pruned to eliminate duplicates Z: 18 19.807 1.996 0.360 0.912 0.941 0.824 CA 1.332 18 residues pruned to eliminate duplicates Z: 85 57.174 2.529 0.544 0.440 0.940 0.643 CB 1.807 85 residues pruned to eliminate duplicates Z: 199 103.849 2.559 0.821 0.555 0.904 0.581 CB 1.661 199 residues pruned to eliminate duplicates Z: 7 8.887 1.641 0.749 0.697 0.833 0.667 CB 1.267 7 residues pruned to eliminate duplicates Z: 40 37.102 2.562 0.624 0.412 0.872 0.564 CB 1.794 40 residues pruned to eliminate duplicates Z: 36 34.707 2.304 0.547 0.568 0.914 0.743 CB 1.685 36 residues pruned to eliminate duplicates Z: 6 4.239 2.004 0.589 0.680 0.400 0.400 CA 1.261 5 residues pruned to eliminate duplicates Z: 224 118.059 2.621 0.811 0.542 0.897 0.574 CB 1.781 224 residues pruned to eliminate duplicates Z: 10 30.518 2.422 1.007 0.890 1.000 0.667 CA 1.505 10 residues pruned to eliminate duplicates Z: 21 33.221 2.128 0.950 0.888 0.950 0.700 CA 1.358 20 residues pruned to eliminate duplicates Z: 11 11.908 2.131 0.654 0.672 0.900 0.700 CB 1.013 9 residues pruned to eliminate duplicates Z: 22 39.299 2.160 0.881 0.864 0.952 0.571 CA 1.624 22 residues pruned to eliminate duplicates Z: 8 3.828 1.760 0.360 0.445 0.857 0.286 CB 0.746 Z: 27 75.746 2.607 1.239 0.899 1.000 0.692 CA 1.819 27 residues pruned to eliminate duplicates Z: 70 59.981 2.635 0.643 0.521 0.899 0.594 CA 1.818 70 residues pruned to eliminate duplicates Z: 16 24.039 2.017 0.628 0.928 1.000 0.733 CA 1.323 16 residues pruned to eliminate duplicates Z: 6 12.332 1.672 0.994 0.812 1.000 0.800 N 1.261 6 residues pruned to eliminate duplicates Z: 13 18.783 2.362 0.713 0.420 0.917 0.583 CB 1.590 13 residues pruned to eliminate duplicates Z: 62 43.484 2.413 0.437 0.559 0.951 0.607 CB 1.594 62 residues pruned to eliminate duplicates Z: 18 26.460 2.243 0.462 0.917 0.941 0.765 CA 1.468 18 residues pruned to eliminate duplicates Z: 11 22.680 1.841 0.934 0.853 1.000 0.700 CA 1.489 Z: 19 36.870 2.269 0.812 0.906 1.000 0.722 CB 1.503 19 residues pruned to eliminate duplicates Z: 23 44.556 2.189 1.033 0.885 1.000 0.864 CA 1.542 23 residues pruned to eliminate duplicates Z: 24 36.286 2.119 0.633 0.896 1.000 0.826 CB 1.566 24 residues pruned to eliminate duplicates Z: 21 16.972 2.266 0.262 0.452 0.850 0.650 CA 1.640 21 residues pruned to eliminate duplicates Z: 23 39.147 2.253 0.950 0.877 0.955 0.455 CA 1.446 23 residues pruned to eliminate duplicates Z: 88 44.096 2.447 0.478 0.446 0.908 0.632 CB 1.522 88 residues pruned to eliminate duplicates Z: 8 9.264 2.153 0.642 0.576 0.857 0.571 CB 1.075 Z: 22 27.686 2.288 0.628 0.822 0.952 0.857 CA 1.288 22 residues pruned to eliminate duplicates Z: 20 11.684 2.150 0.652 0.200 0.737 0.421 CB 1.462 20 residues pruned to eliminate duplicates Z: 18 32.026 2.481 0.425 0.876 0.941 0.824 CA 1.697 18 residues pruned to eliminate duplicates Z: 19 40.649 2.276 0.871 0.916 1.000 0.833 CB 1.589 19 residues pruned to eliminate duplicates Z: 12 12.380 2.270 0.107 0.666 1.000 0.727 CB 1.274 12 residues pruned to eliminate duplicates Z: 6 4.090 1.629 0.054 0.577 1.000 0.600 N 0.989 Z: 17 32.088 2.453 0.323 0.907 0.938 0.938 CA 1.873 17 residues pruned to eliminate duplicates Z: 10 24.815 2.158 0.815 0.852 1.000 0.889 CA 1.562 10 residues pruned to eliminate duplicates Z: 33 30.350 2.339 0.417 0.621 0.938 0.594 CB 1.539 33 residues pruned to eliminate duplicates Z: 8 2.506 1.782 0.078 0.322 0.714 0.429 CB 0.839 Z: 7 7.321 2.239 0.246 0.359 1.000 0.667 CB 1.247 7 residues pruned to eliminate duplicates Z: 12 26.910 2.225 0.700 0.841 0.909 0.636 CA 1.761 12 residues pruned to eliminate duplicates Z: 50 33.630 2.347 0.702 0.466 0.878 0.449 CB 1.419 50 residues pruned to eliminate duplicates Z: 6 9.960 1.930 0.564 0.796 0.800 0.600 CA 1.423 6 residues pruned to eliminate duplicates Z: 95 56.532 2.512 0.466 0.488 0.936 0.670 CB 1.711 95 residues pruned to eliminate duplicates Z: 63 45.787 2.511 0.661 0.474 0.903 0.532 CB 1.585 63 residues pruned to eliminate duplicates Z: 91 59.504 2.590 0.588 0.451 0.933 0.611 CB 1.718 91 residues pruned to eliminate duplicates Z: 8 3.210 1.819 0.018 0.492 0.571 0.571 CB 1.155 Z: 6 11.874 1.838 0.960 0.626 1.000 0.800 N 1.309 Z: 12 7.667 2.127 0.633 0.224 0.727 0.364 CB 1.264 Z: 12 23.685 2.251 0.416 0.879 1.000 0.727 CA 1.624 12 residues pruned to eliminate duplicates Z: 13 23.886 2.223 0.547 0.883 1.000 0.833 CA 1.450 13 residues pruned to eliminate duplicates Z: 13 13.272 2.124 0.121 0.788 0.917 0.833 CB 1.363 13 residues pruned to eliminate duplicates Z: 83 51.932 2.464 0.543 0.423 0.951 0.585 CB 1.717 83 residues pruned to eliminate duplicates Z: 11 22.073 2.237 0.367 0.840 1.000 0.700 CB 1.704 11 residues pruned to eliminate duplicates Z: 80 70.176 2.646 0.557 0.564 0.911 0.646 CB 1.975 80 residues pruned to eliminate duplicates Z: 26 36.984 2.224 0.719 0.898 1.000 0.840 CA 1.384 26 residues pruned to eliminate duplicates Z: 19 39.399 2.385 0.646 0.879 1.000 0.722 CB 1.716 19 residues pruned to eliminate duplicates Z: 19 45.705 2.396 0.707 0.901 1.000 0.722 CA 1.881 19 residues pruned to eliminate duplicates Z: 66 66.437 2.593 0.763 0.570 0.954 0.677 CA 1.766 62 residues pruned to eliminate duplicates Z: 28 36.661 2.485 0.666 0.635 0.778 0.630 CB 1.930 28 residues pruned to eliminate duplicates Z: 99 60.759 2.515 0.608 0.457 0.908 0.592 CB 1.746 99 residues pruned to eliminate duplicates Z: 97 60.663 2.527 0.557 0.491 0.938 0.625 CB 1.694 97 residues pruned to eliminate duplicates Z: 110 83.866 2.590 0.839 0.566 0.899 0.596 CB 1.759 110 residues pruned to eliminate duplicates Z: 17 33.984 2.472 0.567 0.888 0.938 0.750 CA 1.685 17 residues pruned to eliminate duplicates Z: 230 120.318 2.593 0.752 0.557 0.913 0.651 CB 1.814 230 residues pruned to eliminate duplicates Z: 91 84.915 2.577 0.942 0.616 0.911 0.622 CB 1.759 91 residues pruned to eliminate duplicates Z: 20 71.164 2.687 1.221 0.921 0.947 0.684 CA 2.033 20 residues pruned to eliminate duplicates Z: 20 43.311 2.563 0.756 0.883 0.895 0.842 CA 1.785 20 residues pruned to eliminate duplicates 6 1.718 1.968 -0.311 0.685 0.800 0.800 CB 0.597 ? Z: 13 4.305 1.942 -0.050 0.453 0.750 0.333 CB 0.943 Z: 20 34.786 2.349 0.712 0.875 0.947 0.789 CA 1.524 20 residues pruned to eliminate duplicates Z: 11 20.836 1.979 1.284 0.812 0.800 0.500 CA 1.389 11 residues pruned to eliminate duplicates Z: 20 23.537 1.942 0.639 0.907 1.000 0.895 CA 1.205 20 residues pruned to eliminate duplicates Z: 13 21.510 2.150 0.511 0.815 0.917 0.833 CA 1.585 13 residues pruned to eliminate duplicates Z: 7 12.587 2.327 0.278 0.716 1.000 0.833 CB 1.420 7 residues pruned to eliminate duplicates Z: 9 22.800 2.029 0.834 0.896 1.000 0.875 CA 1.551 9 residues pruned to eliminate duplicates Z: 7 11.072 1.943 1.228 0.632 0.833 0.833 CB 1.107 Z: 84 52.040 2.410 0.619 0.546 0.855 0.614 CB 1.637 84 residues pruned to eliminate duplicates Z: 85 80.878 2.708 0.707 0.560 0.940 0.631 CB 1.916 85 residues pruned to eliminate duplicates Z: 21 31.991 2.212 0.627 0.898 1.000 1.000 CB 1.422 21 residues pruned to eliminate duplicates Z: 15 31.572 2.361 0.970 0.915 1.000 0.857 CA 1.282 15 residues pruned to eliminate duplicates Z: 18 53.083 2.319 1.497 0.919 0.941 0.765 CA 1.665 18 residues pruned to eliminate duplicates Z: 19 33.787 2.388 0.504 0.883 0.889 0.833 CA 1.803 19 residues pruned to eliminate duplicates Z: 42 29.648 2.073 0.662 0.539 0.878 0.634 CB 1.473 42 residues pruned to eliminate duplicates Z: 15 8.898 2.173 0.244 0.227 0.786 0.357 CB 1.539 15 residues pruned to eliminate duplicates Z: 11 28.356 2.627 0.741 0.856 0.900 0.500 CA 1.607 11 residues pruned to eliminate duplicates Z: 20 39.713 2.344 0.661 0.920 1.000 0.842 CA 1.648 20 residues pruned to eliminate duplicates Z: 6 3.080 1.242 0.769 0.574 0.800 0.800 CB 0.730 Z: 25 33.658 2.292 0.771 0.906 0.958 0.875 CA 1.256 25 residues pruned to eliminate duplicates Z: 47 71.765 2.635 1.083 0.640 0.891 0.283 CA 1.898 47 residues pruned to eliminate duplicates Z: 13 9.958 2.371 0.156 0.286 0.833 0.667 CA 1.600 13 residues pruned to eliminate duplicates Z: 79 40.555 2.458 0.394 0.449 0.897 0.628 CB 1.574 79 residues pruned to eliminate duplicates Z: 7 4.633 1.783 1.075 0.405 0.500 0.500 CB 1.129 Z: 8 12.828 2.007 0.539 0.683 0.857 0.571 CA 1.549 8 residues pruned to eliminate duplicates Z: 135 83.207 2.554 0.631 0.528 0.925 0.672 CB 1.814 135 residues pruned to eliminate duplicates Z: 6 10.105 1.951 0.505 0.733 1.000 0.600 CA 1.248 6 residues pruned to eliminate duplicates Z: 12 25.487 2.252 0.523 0.884 1.000 0.727 CB 1.620 12 residues pruned to eliminate duplicates Z: 6 3.811 1.796 0.686 0.481 0.800 0.800 CB 0.717 Z: 29 36.500 2.534 0.557 0.597 0.929 0.679 CB 1.716 29 residues pruned to eliminate duplicates Z: 19 32.706 2.535 0.726 0.931 1.000 0.944 CA 1.231 19 residues pruned to eliminate duplicates Z: 13 15.117 2.206 0.969 0.315 0.750 0.667 CB 1.644 Z: 23 27.595 2.437 0.713 0.494 0.909 0.591 CB 1.560 23 residues pruned to eliminate duplicates Z: 22 45.475 2.298 1.074 0.861 0.952 0.524 CB 1.607 24 residues pruned to eliminate duplicates Z: 26 24.615 2.482 0.754 0.386 0.800 0.400 CB 1.595 26 residues pruned to eliminate duplicates Z: 24 67.654 2.761 1.374 0.902 1.000 0.652 CA 1.535 24 residues pruned to eliminate duplicates Z: 96 52.896 2.484 0.650 0.438 0.853 0.547 CB 1.656 96 residues pruned to eliminate duplicates Z: 59 68.524 2.580 0.916 0.664 0.914 0.603 CA 1.711 59 residues pruned to eliminate duplicates Z: 17 10.355 2.148 0.526 0.370 0.812 0.562 CB 1.117 17 residues pruned to eliminate duplicates Z: 12 29.398 2.289 0.937 0.825 1.000 0.727 CA 1.509 11 residues pruned to eliminate duplicates Z: 22 36.425 2.330 0.463 0.892 1.000 0.857 CA 1.674 22 residues pruned to eliminate duplicates Z: 14 21.757 2.091 0.454 0.829 1.000 0.769 CA 1.493 14 residues pruned to eliminate duplicates Z: 29 47.917 2.372 1.189 0.818 0.857 0.536 CA 1.544 29 residues pruned to eliminate duplicates Z: 110 93.415 2.559 0.990 0.602 0.927 0.560 CB 1.721 110 residues pruned to eliminate duplicates Z: 11 16.061 2.077 0.425 0.858 0.900 0.700 N 1.405 11 residues pruned to eliminate duplicates Z: 21 41.272 2.228 0.962 0.904 1.000 0.650 CB 1.504 21 residues pruned to eliminate duplicates Z: 80 50.361 2.498 0.531 0.447 0.924 0.620 CB 1.693 80 residues pruned to eliminate duplicates Z: 20 31.592 2.386 0.621 0.882 0.947 0.947 CA 1.431 20 residues pruned to eliminate duplicates Z: 9 10.352 1.984 0.460 0.555 1.000 0.750 CB 1.198 9 residues pruned to eliminate duplicates Z: 9 27.614 2.300 1.537 0.780 0.875 0.750 CA 1.494 9 residues pruned to eliminate duplicates Z: 17 18.210 1.978 0.400 0.907 1.000 0.812 CA 1.168 17 residues pruned to eliminate duplicates Z: 21 42.669 2.211 1.111 0.924 1.000 0.550 CB 1.435 21 residues pruned to eliminate duplicates Z: 7 8.002 2.081 0.436 0.411 0.833 0.833 CA 1.440 3 residues pruned to eliminate duplicates Z: 38 34.194 2.309 0.556 0.522 0.919 0.649 CB 1.666 38 residues pruned to eliminate duplicates Z: 18 26.057 2.021 0.808 0.906 1.000 0.765 CB 1.230 18 residues pruned to eliminate duplicates Z: 59 48.520 2.641 0.453 0.506 0.914 0.569 CB 1.806 59 residues pruned to eliminate duplicates Z: 23 59.145 2.850 1.104 0.933 0.955 0.682 CA 1.537 23 residues pruned to eliminate duplicates Z: 19 31.141 2.508 0.519 0.895 1.000 0.833 CA 1.381 19 residues pruned to eliminate duplicates Z: 21 37.094 2.253 0.679 0.888 1.000 0.850 CA 1.580 21 residues pruned to eliminate duplicates Z: 13 13.320 2.286 0.864 0.511 0.583 0.250 CB 1.530 13 residues pruned to eliminate duplicates Z: 38 19.701 1.813 0.614 0.487 0.919 0.595 CB 1.220 38 residues pruned to eliminate duplicates Z: 19 34.788 2.486 0.597 0.908 0.944 0.833 CA 1.552 19 residues pruned to eliminate duplicates Z: 8 14.492 1.998 0.384 0.828 1.000 0.571 N 1.491 8 residues pruned to eliminate duplicates Z: 6 6.089 2.222 -0.066 0.802 1.000 1.000 CB 1.008 6 residues pruned to eliminate duplicates Z: 29 38.289 2.553 0.506 0.650 0.964 0.643 CB 1.697 29 residues pruned to eliminate duplicates Z: 21 48.049 2.393 1.195 0.915 0.950 0.800 CA 1.522 21 residues pruned to eliminate duplicates Z: 28 49.653 2.496 1.053 0.853 0.926 0.667 CA 1.489 28 residues pruned to eliminate duplicates Z: 18 34.621 2.184 0.706 0.904 1.000 0.765 CA 1.605 18 residues pruned to eliminate duplicates Z: 13 8.502 1.811 0.817 0.257 0.667 0.167 N 1.477 Z: 16 36.245 2.331 0.880 0.908 1.000 0.933 CA 1.517 16 residues pruned to eliminate duplicates Z: 19 39.511 2.564 0.657 0.903 1.000 0.778 CA 1.562 19 residues pruned to eliminate duplicates Z: 34 37.383 2.516 0.656 0.633 0.909 0.667 CB 1.516 34 residues pruned to eliminate duplicates Z: 20 30.344 2.212 0.445 0.909 0.947 0.947 CB 1.631 20 residues pruned to eliminate duplicates Z: 20 38.875 2.348 0.712 0.866 1.000 0.842 CA 1.624 20 residues pruned to eliminate duplicates Z: 72 57.987 2.465 0.620 0.565 0.958 0.732 CB 1.688 72 residues pruned to eliminate duplicates Z: 8 5.246 2.189 0.425 0.209 0.714 0.429 CB 1.255 8 residues pruned to eliminate duplicates Z: 18 42.356 2.541 0.930 0.915 1.000 0.765 CA 1.481 18 residues pruned to eliminate duplicates Z: 9 29.651 2.433 0.779 0.892 1.000 0.625 CB 1.739 9 residues pruned to eliminate duplicates Z: 18 31.166 2.103 0.720 0.907 1.000 0.824 CA 1.485 18 residues pruned to eliminate duplicates Z: 18 32.015 2.515 0.399 0.889 1.000 0.824 CA 1.589 18 residues pruned to eliminate duplicates Z: 10 2.780 1.802 0.135 0.204 0.778 0.333 CB 0.828 6 1.396 1.557 0.000 0.457 0.600 0.400 N 0.698 ? Z: 25 34.892 2.232 0.935 0.857 0.875 0.625 CA 1.388 25 residues pruned to eliminate duplicates Z: 7 16.075 2.381 0.119 0.852 1.000 0.833 CA 1.821 7 residues pruned to eliminate duplicates Z: 18 43.493 2.294 1.117 0.902 1.000 0.765 CA 1.549 18 residues pruned to eliminate duplicates Z: 39 31.456 2.178 0.549 0.625 0.816 0.553 CA 1.649 71 residues pruned to eliminate duplicates Z: 18 31.437 2.193 0.725 0.861 0.941 0.824 CB 1.574 18 residues pruned to eliminate duplicates Z: 6 5.272 1.616 0.465 0.476 0.800 0.600 CB 1.276 Z: 14 9.367 1.926 0.478 0.473 0.846 0.385 CB 1.109 Z: 80 68.728 2.556 0.872 0.599 0.848 0.532 CB 1.733 81 residues pruned to eliminate duplicates Z: 8 13.400 2.300 0.392 0.805 0.857 0.714 N 1.415 8 residues pruned to eliminate duplicates Z: 21 40.171 2.248 0.847 0.902 1.000 0.850 CB 1.543 21 residues pruned to eliminate duplicates Z: 67 42.240 2.409 0.529 0.460 0.924 0.576 CB 1.591 67 residues pruned to eliminate duplicates Z: 41 20.622 2.230 0.293 0.386 0.850 0.350 CB 1.502 41 residues pruned to eliminate duplicates Z: 17 15.852 2.263 0.450 0.463 0.875 0.625 CB 1.434 17 residues pruned to eliminate duplicates Z: 14 19.415 1.847 0.532 0.833 1.000 0.692 CA 1.428 14 residues pruned to eliminate duplicates Z: 22 37.545 2.152 0.767 0.875 1.000 0.905 CB 1.567 22 residues pruned to eliminate duplicates Z: 25 28.083 2.273 0.822 0.600 0.958 0.708 CB 1.313 25 residues pruned to eliminate duplicates Z: 6 16.940 2.397 0.854 0.615 1.000 0.600 CA 1.528 6 residues pruned to eliminate duplicates Z: 19 35.186 2.529 0.568 0.895 1.000 0.833 CA 1.499 19 residues pruned to eliminate duplicates Z: 7 6.415 1.906 0.603 0.406 0.667 0.500 CB 1.420 Z: 23 41.385 2.237 0.736 0.908 1.000 0.818 CB 1.613 22 residues pruned to eliminate duplicates Z: 11 13.127 2.358 0.281 0.632 0.800 0.800 CB 1.517 11 residues pruned to eliminate duplicates Z: 41 52.159 2.570 0.832 0.552 0.950 0.700 CB 1.752 41 residues pruned to eliminate duplicates Z: 17 8.141 2.121 0.112 0.289 0.812 0.312 CB 1.347 17 residues pruned to eliminate duplicates Z: 10 11.265 2.091 0.943 0.691 0.556 0.444 CB 1.396 10 residues pruned to eliminate duplicates Z: 89 44.118 2.439 0.449 0.408 0.875 0.614 CB 1.675 89 residues pruned to eliminate duplicates Z: 20 40.176 2.287 1.214 0.905 0.947 0.421 CB 1.368 20 residues pruned to eliminate duplicates Z: 58 59.134 2.584 0.929 0.582 0.825 0.526 CB 1.762 58 residues pruned to eliminate duplicates Z: 8 21.245 2.666 0.714 0.864 0.857 0.714 CA 1.503 8 residues pruned to eliminate duplicates Z: 8 24.359 2.445 1.503 0.673 0.857 0.571 CB 1.495 8 residues pruned to eliminate duplicates Z: 8 8.095 1.747 0.672 0.728 1.000 0.714 CB 0.853 8 residues pruned to eliminate duplicates Z: 21 49.075 2.286 1.180 0.903 1.000 0.800 CA 1.570 21 residues pruned to eliminate duplicates Z: 6 3.738 1.704 0.419 0.498 0.800 0.600 N 0.866 Z: 26 59.848 2.521 1.241 0.876 0.880 0.600 CA 1.750 26 residues pruned to eliminate duplicates Z: 11 16.013 2.060 0.596 0.691 0.800 0.400 CB 1.616 11 residues pruned to eliminate duplicates Z: 21 12.678 2.101 0.303 0.386 0.850 0.500 CB 1.375 21 residues pruned to eliminate duplicates Z: 8 3.724 1.778 -0.042 0.577 0.857 0.429 CB 0.895 Z: 9 22.858 2.233 0.663 0.794 1.000 0.750 CA 1.682 9 residues pruned to eliminate duplicates Z: 7 9.928 2.152 0.067 0.881 1.000 0.833 CA 1.279 7 residues pruned to eliminate duplicates Z: 8 16.900 2.146 0.598 0.854 1.000 1.000 CA 1.375 8 residues pruned to eliminate duplicates Z: 10 20.787 1.920 1.270 0.849 1.000 0.667 CA 1.179 10 residues pruned to eliminate duplicates Z: 9 13.826 2.141 0.363 0.844 0.875 0.875 CA 1.424 9 residues pruned to eliminate duplicates Z: 22 37.218 2.158 0.779 0.894 1.000 0.905 CA 1.517 22 residues pruned to eliminate duplicates Z: 9 7.341 2.038 0.605 0.617 0.750 0.625 CB 0.948 Z: 28 15.932 2.226 0.301 0.371 0.889 0.444 CB 1.367 28 residues pruned to eliminate duplicates Z: 12 20.494 2.122 0.940 0.773 0.818 0.545 CB 1.441 12 residues pruned to eliminate duplicates Z: 23 36.131 2.261 0.713 0.870 0.955 0.682 CA 1.522 23 residues pruned to eliminate duplicates Z: 14 16.244 2.293 0.313 0.516 0.923 0.538 CB 1.596 14 residues pruned to eliminate duplicates Z: 10 20.759 1.901 0.795 0.874 1.000 0.778 CA 1.476 10 residues pruned to eliminate duplicates Z: 25 71.461 2.576 1.361 0.926 0.958 0.583 CA 1.755 25 residues pruned to eliminate duplicates Z: 207 122.721 2.614 0.798 0.564 0.913 0.626 CB 1.874 207 residues pruned to eliminate duplicates Z: 7 5.431 1.699 0.501 0.413 1.000 0.833 CB 0.952 Z: 18 40.265 2.466 1.038 0.854 0.882 0.412 CA 1.627 18 residues pruned to eliminate duplicates Z: 16 23.101 2.318 0.904 0.459 0.800 0.533 CA 1.762 16 residues pruned to eliminate duplicates Z: 9 11.910 2.092 0.527 0.667 0.750 0.500 CB 1.506 9 residues pruned to eliminate duplicates Z: 22 21.107 2.506 0.308 0.385 0.857 0.714 CA 1.852 22 residues pruned to eliminate duplicates Z: 111 106.308 2.690 1.030 0.635 0.927 0.655 CA 1.764 111 residues pruned to eliminate duplicates Z: 7 6.547 1.826 0.219 0.465 0.833 0.333 CA 1.494 7 residues pruned to eliminate duplicates Z: 43 34.131 2.314 0.647 0.454 0.857 0.571 CB 1.690 43 residues pruned to eliminate duplicates Z: 17 27.969 2.463 0.719 0.591 0.938 0.625 CA 1.614 17 residues pruned to eliminate duplicates Z: 14 24.967 1.980 0.966 0.735 0.923 0.538 CA 1.560 14 residues pruned to eliminate duplicates Z: 6 4.365 1.846 0.482 0.445 0.600 0.400 N 1.258 Z: 29 56.111 2.485 1.197 0.847 0.929 0.714 CA 1.553 29 residues pruned to eliminate duplicates Z: 8 7.808 1.742 0.788 0.590 0.714 0.714 N 1.217 Z: 17 29.943 2.222 0.699 0.876 0.875 0.750 CA 1.647 17 residues pruned to eliminate duplicates Z: 13 12.973 2.064 0.872 0.345 0.667 0.333 CA 1.720 Z: 83 49.151 2.494 0.597 0.392 0.902 0.585 CB 1.693 83 residues pruned to eliminate duplicates Z: 6 9.140 2.039 0.613 0.486 0.800 0.600 N 1.576 Z: 6 21.401 2.022 1.180 0.786 1.000 0.600 O 1.688 6 residues pruned to eliminate duplicates Z: 9 8.221 1.999 0.426 0.670 0.750 0.625 CB 1.162 9 residues pruned to eliminate duplicates Z: 18 32.365 2.192 0.568 0.869 1.000 0.647 CA 1.668 18 residues pruned to eliminate duplicates Z: 9 19.045 2.237 0.951 0.521 1.000 0.875 CA 1.511 9 residues pruned to eliminate duplicates Z: 35 33.361 2.328 0.606 0.639 0.824 0.647 CB 1.631 46 residues pruned to eliminate duplicates Z: 46 32.979 2.444 0.413 0.504 0.933 0.711 CB 1.519 46 residues pruned to eliminate duplicates Z: 18 30.398 2.093 0.941 0.825 0.941 0.647 CB 1.456 18 residues pruned to eliminate duplicates Z: 55 52.261 2.502 0.619 0.606 0.963 0.741 CA 1.647 59 residues pruned to eliminate duplicates Z: 97 60.405 2.475 0.569 0.518 0.917 0.698 CB 1.702 97 residues pruned to eliminate duplicates Z: 7 4.574 1.747 0.415 0.717 1.000 0.500 CA 0.621 7 residues pruned to eliminate duplicates Z: 11 18.232 2.298 0.521 0.523 1.000 0.600 CB 1.611 10 residues pruned to eliminate duplicates Z: 9 7.442 1.913 0.753 0.293 0.750 0.500 CB 1.320 Z: 24 69.057 2.831 1.245 0.928 0.957 0.652 CA 1.658 24 residues pruned to eliminate duplicates Z: 19 17.270 2.265 0.483 0.408 0.944 0.611 CB 1.412 19 residues pruned to eliminate duplicates Z: 22 39.398 2.452 0.647 0.743 0.952 0.714 CA 1.797 22 residues pruned to eliminate duplicates Z: 19 55.016 2.580 1.267 0.935 1.000 0.722 CA 1.545 19 residues pruned to eliminate duplicates Z: 25 78.205 2.620 1.354 0.899 0.958 0.458 CA 1.930 25 residues pruned to eliminate duplicates 7 1.012 1.455 0.476 0.421 0.667 0.500 CB 0.313 ? Z: 8 15.975 2.084 0.865 0.798 1.000 0.857 CA 1.197 8 residues pruned to eliminate duplicates Z: 6 14.645 2.224 1.199 0.675 1.000 0.800 CB 1.140 Z: 53 34.780 2.370 0.533 0.386 0.923 0.519 CB 1.623 53 residues pruned to eliminate duplicates Z: 94 53.220 2.451 0.787 0.422 0.860 0.516 CB 1.589 94 residues pruned to eliminate duplicates Z: 91 51.777 2.448 0.589 0.391 0.922 0.478 CB 1.709 91 residues pruned to eliminate duplicates Z: 7 2.455 1.415 0.120 0.666 0.667 0.667 C 0.814 7 residues pruned to eliminate duplicates Z: 26 48.145 2.534 1.020 0.594 0.920 0.440 CB 1.868 26 residues pruned to eliminate duplicates Z: 11 28.745 2.372 0.848 0.898 1.000 0.900 CA 1.483 11 residues pruned to eliminate duplicates Z: 19 16.290 2.363 0.473 0.267 0.889 0.444 CB 1.619 19 residues pruned to eliminate duplicates Z: 19 32.637 2.358 0.737 0.834 0.889 0.722 CB 1.583 19 residues pruned to eliminate duplicates Z: 18 32.445 2.296 0.863 0.937 0.941 0.706 CA 1.360 18 residues pruned to eliminate duplicates Z: 26 47.598 2.586 0.865 0.901 0.960 0.800 CA 1.467 26 residues pruned to eliminate duplicates Z: 38 39.428 2.499 0.645 0.413 1.000 0.486 CB 1.727 38 residues pruned to eliminate duplicates Z: 63 39.950 2.385 0.585 0.399 0.887 0.597 CB 1.684 63 residues pruned to eliminate duplicates Z: 27 28.550 2.337 0.925 0.507 0.885 0.654 CB 1.398 27 residues pruned to eliminate duplicates Z: 18 37.879 2.445 0.723 0.905 1.000 0.647 CB 1.553 18 residues pruned to eliminate duplicates Z: 77 44.373 2.462 0.513 0.459 0.895 0.618 CB 1.593 77 residues pruned to eliminate duplicates Z: 19 44.163 2.382 0.620 0.929 1.000 0.944 CB 1.888 19 residues pruned to eliminate duplicates Z: 16 19.585 2.325 0.761 0.303 0.933 0.533 CB 1.648 16 residues pruned to eliminate duplicates Z: 45 39.156 2.519 0.616 0.493 0.886 0.591 CB 1.647 45 residues pruned to eliminate duplicates Z: 34 31.777 2.179 0.952 0.613 0.879 0.667 CB 1.330 34 residues pruned to eliminate duplicates Z: 8 15.622 2.097 1.187 0.670 0.857 0.571 CB 1.284 8 residues pruned to eliminate duplicates Z: 25 15.791 2.173 0.617 0.402 0.708 0.458 CB 1.436 25 residues pruned to eliminate duplicates Z: 21 54.136 2.420 1.148 0.928 1.000 0.650 CB 1.631 22 residues pruned to eliminate duplicates Z: 21 26.098 1.870 0.771 0.880 0.900 0.600 CA 1.419 21 residues pruned to eliminate duplicates Z: 25 39.004 2.232 0.839 0.915 0.958 0.833 CB 1.430 25 residues pruned to eliminate duplicates Z: 88 69.859 2.667 0.664 0.542 0.874 0.678 CB 1.855 88 residues pruned to eliminate duplicates Z: 12 13.867 2.395 0.369 0.367 0.818 0.545 CB 1.798 12 residues pruned to eliminate duplicates Z: 78 74.962 2.730 0.623 0.569 0.909 0.675 CB 1.983 78 residues pruned to eliminate duplicates Z: 7 3.014 1.707 -0.102 0.502 0.667 0.500 N 1.202 Z: 9 4.803 2.036 -0.098 0.331 0.750 0.500 CA 1.482 9 residues pruned to eliminate duplicates Z: 18 40.603 2.392 0.889 0.909 0.941 0.706 CA 1.643 18 residues pruned to eliminate duplicates Z: 21 28.169 2.174 0.530 0.858 0.950 0.700 CB 1.467 21 residues pruned to eliminate duplicates Z: 19 39.855 2.265 0.886 0.887 1.000 0.667 CB 1.586 19 residues pruned to eliminate duplicates Z: 22 16.538 2.242 0.797 0.327 0.667 0.476 CB 1.625 22 residues pruned to eliminate duplicates Z: 66 46.408 2.441 0.669 0.495 0.862 0.554 CB 1.648 66 residues pruned to eliminate duplicates Z: 7 15.130 2.254 0.700 0.677 1.000 0.833 CA 1.369 7 residues pruned to eliminate duplicates Z: 29 25.270 2.180 0.768 0.448 0.821 0.429 CB 1.592 29 residues pruned to eliminate duplicates Z: 48 43.733 2.451 0.620 0.562 0.894 0.553 CB 1.693 48 residues pruned to eliminate duplicates Z: 203 121.907 2.596 0.827 0.575 0.921 0.589 CA 1.827 203 residues pruned to eliminate duplicates Z: 14 32.057 2.129 1.248 0.822 0.846 0.846 CB 1.661 14 residues pruned to eliminate duplicates Z: 47 50.690 2.569 0.707 0.563 0.935 0.543 CB 1.716 47 residues pruned to eliminate duplicates Z: 46 58.335 2.636 0.989 0.657 0.889 0.578 CB 1.612 46 residues pruned to eliminate duplicates Z: 7 7.149 1.552 0.673 0.556 0.833 0.833 N 1.278 Z: 9 9.682 2.163 0.441 0.762 0.875 0.625 CB 0.994 9 residues pruned to eliminate duplicates Z: 20 36.118 2.178 0.821 0.922 1.000 0.737 CB 1.470 20 residues pruned to eliminate duplicates Z: 19 24.000 2.242 0.407 0.904 1.000 0.944 CA 1.277 19 residues pruned to eliminate duplicates Z: 24 13.403 2.108 0.333 0.422 0.783 0.435 CB 1.379 24 residues pruned to eliminate duplicates Z: 19 38.280 2.224 0.958 0.912 1.000 0.556 CB 1.467 22 residues pruned to eliminate duplicates Z: 24 17.622 2.299 0.471 0.278 0.913 0.478 CB 1.529 24 residues pruned to eliminate duplicates Z: 23 39.260 2.208 0.598 0.929 1.000 0.955 CA 1.661 23 residues pruned to eliminate duplicates Z: 50 47.244 2.504 0.692 0.492 0.939 0.469 CB 1.711 50 residues pruned to eliminate duplicates Z: 12 7.206 2.191 0.438 0.247 0.727 0.545 CB 1.270 12 residues pruned to eliminate duplicates Z: 119 65.859 2.431 0.718 0.433 0.915 0.525 CB 1.700 109 residues pruned to eliminate duplicates Z: 99 89.849 2.643 0.914 0.603 0.898 0.622 CA 1.811 99 residues pruned to eliminate duplicates Z: 52 47.863 2.495 0.753 0.527 0.843 0.510 CA 1.770 52 residues pruned to eliminate duplicates Z: 37 26.688 2.345 0.501 0.450 0.861 0.472 CB 1.545 37 residues pruned to eliminate duplicates Z: 32 35.833 2.032 0.796 0.859 0.935 0.677 CA 1.388 32 residues pruned to eliminate duplicates Z: 13 22.023 2.041 0.420 0.913 1.000 0.833 CA 1.553 13 residues pruned to eliminate duplicates Z: 6 3.014 1.542 0.705 0.641 0.600 0.400 N 0.749 6 residues pruned to eliminate duplicates Z: 18 19.154 1.871 0.747 0.897 0.824 0.647 CB 1.235 Z: 12 15.704 1.869 0.700 0.780 0.818 0.545 CB 1.422 11 residues pruned to eliminate duplicates Z: 14 27.875 2.196 0.911 0.849 0.846 0.692 CA 1.615 14 residues pruned to eliminate duplicates Z: 14 7.565 2.169 0.277 0.349 0.692 0.308 CB 1.289 14 residues pruned to eliminate duplicates Z: 15 30.967 2.147 0.935 0.859 0.857 0.786 CB 1.710 15 residues pruned to eliminate duplicates Z: 17 6.372 1.495 0.469 0.302 0.812 0.312 CB 1.114 Z: 11 6.905 2.021 0.996 0.395 0.600 0.500 CB 1.009 Z: 6 11.561 2.036 0.489 0.804 1.000 0.800 CA 1.307 6 residues pruned to eliminate duplicates Z: 12 13.819 2.337 0.347 0.429 0.909 0.545 CB 1.568 12 residues pruned to eliminate duplicates Z: 12 17.129 1.731 0.690 0.883 0.909 0.636 CA 1.404 12 residues pruned to eliminate duplicates Z: 6 2.274 1.473 0.380 0.275 0.800 0.600 CB 0.807 Z: 65 41.713 2.411 0.571 0.425 0.906 0.594 CB 1.643 65 residues pruned to eliminate duplicates Z: 7 5.893 1.313 1.419 0.812 1.000 0.833 N 0.577 Z: 27 41.186 2.392 0.668 0.863 1.000 0.846 CA 1.486 27 residues pruned to eliminate duplicates Z: 56 51.770 2.474 0.799 0.474 0.891 0.636 CB 1.807 56 residues pruned to eliminate duplicates Z: 19 17.487 2.422 0.659 0.554 0.833 0.556 CB 1.169 19 residues pruned to eliminate duplicates Z: 18 28.614 2.025 0.860 0.918 1.000 0.765 CA 1.299 18 residues pruned to eliminate duplicates Z: 34 38.697 2.492 0.553 0.651 0.788 0.667 CA 1.919 34 residues pruned to eliminate duplicates Z: 37 34.405 2.396 0.605 0.508 0.861 0.694 CB 1.717 37 residues pruned to eliminate duplicates Z: 26 72.536 2.659 1.242 0.883 0.920 0.520 CB 1.913 26 residues pruned to eliminate duplicates Z: 6 4.385 1.743 0.272 0.298 0.800 0.600 N 1.384 Z: 24 40.369 2.236 1.205 0.851 0.826 0.522 CA 1.529 24 residues pruned to eliminate duplicates Z: 46 49.692 2.540 0.680 0.566 0.889 0.556 CB 1.832 46 residues pruned to eliminate duplicates Z: 8 15.554 2.128 0.671 0.880 0.857 0.429 CB 1.398 8 residues pruned to eliminate duplicates Z: 9 16.724 2.196 0.605 0.849 0.875 0.500 CA 1.421 9 residues pruned to eliminate duplicates Z: 6 13.711 2.178 0.780 0.821 1.000 0.600 CA 1.197 6 residues pruned to eliminate duplicates Z: 72 44.973 2.470 0.610 0.426 0.873 0.592 CB 1.660 72 residues pruned to eliminate duplicates Z: 10 14.256 1.842 0.547 0.820 0.889 0.778 CA 1.422 10 residues pruned to eliminate duplicates Z: 9 7.165 1.849 1.253 0.385 0.500 0.375 CB 1.373 Z: 25 46.736 2.580 0.784 0.858 0.917 0.875 CA 1.665 25 residues pruned to eliminate duplicates Z: 73 58.849 2.578 0.661 0.524 0.917 0.583 CA 1.726 38 residues pruned to eliminate duplicates Z: 7 7.383 1.980 0.425 0.657 0.833 0.667 CB 1.108 7 residues pruned to eliminate duplicates Z: 18 16.810 2.308 0.591 0.288 0.824 0.471 CA 1.710 13 residues pruned to eliminate duplicates Z: 6 11.035 1.916 0.573 0.751 1.000 0.600 CB 1.309 6 residues pruned to eliminate duplicates Z: 6 6.285 1.849 0.403 0.507 0.800 0.400 N 1.345 Z: 10 16.177 1.909 0.677 0.855 0.889 0.889 CA 1.398 10 residues pruned to eliminate duplicates Z: 11 22.646 2.396 0.553 0.857 1.000 0.800 CA 1.418 20 residues pruned to eliminate duplicates Z: 64 41.448 2.379 0.540 0.422 0.921 0.540 CB 1.680 64 residues pruned to eliminate duplicates 6 1.220 2.013 0.180 0.550 0.600 0.600 CB 0.364 ? Z: 10 4.133 1.875 0.282 0.384 0.667 0.556 CA 0.972 Z: 23 12.253 1.883 0.432 0.505 0.773 0.591 CB 1.248 Z: 6 2.257 1.882 0.724 0.414 0.600 0.600 CB 0.567 Z: 116 87.730 2.557 0.960 0.583 0.878 0.548 CA 1.716 116 residues pruned to eliminate duplicates Z: 8 6.966 1.956 0.287 0.479 0.857 0.571 N 1.247 Z: 20 27.827 2.196 0.538 0.934 1.000 0.895 CB 1.319 20 residues pruned to eliminate duplicates Z: 23 46.128 2.231 0.991 0.919 1.000 0.864 CB 1.559 23 residues pruned to eliminate duplicates Z: 6 2.567 1.901 -0.126 0.408 1.000 0.600 CB 0.760 Z: 19 27.019 2.085 0.687 0.865 0.889 0.611 CB 1.492 19 residues pruned to eliminate duplicates Z: 14 28.650 2.013 0.802 0.892 0.923 0.692 CB 1.705 14 residues pruned to eliminate duplicates Z: 8 16.961 2.047 1.059 0.845 1.000 0.857 CA 1.131 8 residues pruned to eliminate duplicates Z: 24 30.467 2.075 0.624 0.866 0.957 0.696 CB 1.443 24 residues pruned to eliminate duplicates Z: 7 16.841 2.346 0.625 0.833 0.833 0.667 CA 1.624 7 residues pruned to eliminate duplicates Z: 73 49.315 2.533 0.678 0.434 0.903 0.458 CB 1.623 73 residues pruned to eliminate duplicates Z: 6 11.204 1.992 1.454 0.779 0.800 0.200 CB 1.002 Z: 9 4.103 1.606 0.757 0.414 0.625 0.500 CB 0.900 Z: 9 21.157 1.942 1.399 0.730 1.000 0.625 CB 1.305 9 residues pruned to eliminate duplicates Z: 16 10.278 1.881 0.240 0.332 0.933 0.400 N 1.466 16 residues pruned to eliminate duplicates Z: 73 71.370 2.670 0.889 0.623 0.889 0.569 CB 1.671 73 residues pruned to eliminate duplicates Z: 31 23.237 2.089 0.515 0.592 0.933 0.733 CB 1.315 31 residues pruned to eliminate duplicates Z: 23 82.779 2.719 1.559 0.932 0.955 0.500 CB 1.856 23 residues pruned to eliminate duplicates Z: 173 123.381 2.634 0.907 0.598 0.936 0.599 CB 1.822 173 residues pruned to eliminate duplicates Z: 11 4.443 1.760 1.088 0.307 0.400 0.400 CB 1.184 Z: 10 13.779 1.862 0.486 0.877 0.889 0.556 CB 1.356 10 residues pruned to eliminate duplicates Z: 7 17.711 2.333 0.345 0.855 1.000 1.000 CA 1.700 7 residues pruned to eliminate duplicates Z: 40 53.068 2.676 0.790 0.566 0.846 0.718 CA 1.967 40 residues pruned to eliminate duplicates Z: 46 41.408 2.532 0.448 0.583 0.867 0.644 CA 1.794 46 residues pruned to eliminate duplicates Z: 101 43.154 2.374 0.483 0.414 0.870 0.630 CB 1.541 101 residues pruned to eliminate duplicates Z: 18 29.050 2.148 0.612 0.899 1.000 0.765 CA 1.455 18 residues pruned to eliminate duplicates Z: 10 9.214 1.936 0.629 0.418 0.778 0.444 CA 1.364 Z: 6 12.601 2.169 0.813 0.729 1.000 0.600 CA 1.166 6 residues pruned to eliminate duplicates Z: 7 24.552 2.491 0.924 0.697 1.000 0.667 CB 1.746 6 residues pruned to eliminate duplicates Z: 64 36.485 2.290 0.499 0.377 0.889 0.508 CB 1.718 64 residues pruned to eliminate duplicates Z: 57 51.597 2.537 0.705 0.525 0.893 0.643 CB 1.742 57 residues pruned to eliminate duplicates Z: 35 57.471 2.551 1.225 0.662 0.941 0.529 CA 1.588 35 residues pruned to eliminate duplicates Z: 8 5.707 1.716 1.040 0.220 0.857 0.429 CA 0.998 Z: 18 40.817 2.629 0.660 0.927 1.000 0.882 CA 1.590 18 residues pruned to eliminate duplicates Z: 183 96.012 2.568 0.635 0.528 0.940 0.637 CB 1.756 183 residues pruned to eliminate duplicates Z: 6 7.854 1.626 0.843 0.537 1.000 0.600 N 1.130 6 residues pruned to eliminate duplicates Z: 38 41.644 2.538 0.644 0.565 0.919 0.676 CB 1.677 30 residues pruned to eliminate duplicates Z: 18 40.673 2.319 1.010 0.922 1.000 0.706 CA 1.488 18 residues pruned to eliminate duplicates Z: 7 3.556 1.667 -0.200 0.507 1.000 0.667 CB 1.081 Z: 12 7.558 1.703 0.859 0.379 0.818 0.636 CB 1.000 10 residues pruned to eliminate duplicates Z: 73 42.559 2.364 0.637 0.398 0.889 0.583 CB 1.624 73 residues pruned to eliminate duplicates Z: 25 51.223 2.517 1.002 0.629 1.000 0.292 CA 1.837 25 residues pruned to eliminate duplicates Z: 20 17.031 1.912 0.403 0.888 0.947 0.842 CA 1.108 20 residues pruned to eliminate duplicates Z: 15 6.653 1.984 0.466 0.351 0.714 0.429 CB 1.006 15 residues pruned to eliminate duplicates Z: 23 12.120 2.141 0.227 0.315 0.864 0.545 CB 1.397 23 residues pruned to eliminate duplicates Z: 18 11.916 2.274 0.296 0.244 0.882 0.471 CB 1.494 18 residues pruned to eliminate duplicates Z: 25 29.174 2.490 0.386 0.570 0.875 0.708 CA 1.843 25 residues pruned to eliminate duplicates Z: 18 20.748 1.971 0.699 0.893 0.765 0.529 CA 1.411 18 residues pruned to eliminate duplicates Z: 7 2.448 1.983 0.034 0.807 0.833 0.833 CB 0.448 Z: 6 5.229 1.826 0.463 0.308 1.000 0.600 N 1.082 Z: 19 48.054 2.247 1.290 0.898 1.000 0.333 CB 1.574 20 residues pruned to eliminate duplicates Z: 33 31.384 2.424 0.327 0.581 0.938 0.688 CB 1.703 33 residues pruned to eliminate duplicates Z: 87 71.618 2.542 0.894 0.543 0.884 0.593 CB 1.740 87 residues pruned to eliminate duplicates Z: 49 33.304 2.400 0.497 0.476 0.917 0.583 CB 1.496 49 residues pruned to eliminate duplicates Z: 10 12.128 1.920 0.805 0.717 0.889 0.444 CB 1.078 10 residues pruned to eliminate duplicates Z: 35 26.060 2.155 0.518 0.469 0.853 0.588 CB 1.654 35 residues pruned to eliminate duplicates Z: 9 24.642 2.374 0.658 0.809 1.000 0.750 N 1.692 9 residues pruned to eliminate duplicates Z: 7 10.655 2.263 0.548 0.547 1.000 0.833 CB 1.185 Z: 6 4.305 1.670 -0.202 0.532 1.000 0.600 O 1.399 Z: 60 46.732 2.521 0.599 0.534 0.847 0.627 CB 1.724 60 residues pruned to eliminate duplicates Z: 20 44.782 2.248 1.173 0.900 1.000 0.632 CB 1.502 20 residues pruned to eliminate duplicates Z: 6 3.578 1.713 0.807 0.646 0.600 0.400 CB 0.751 Z: 17 17.487 2.001 0.352 0.914 1.000 0.812 CA 1.143 17 residues pruned to eliminate duplicates Z: 18 34.565 2.363 0.635 0.875 0.882 0.647 CB 1.789 18 residues pruned to eliminate duplicates Z: 19 31.542 2.273 0.883 0.793 0.889 0.500 CB 1.511 19 residues pruned to eliminate duplicates Z: 12 12.633 2.247 0.430 0.323 0.818 0.545 CA 1.761 12 residues pruned to eliminate duplicates Z: 6 5.113 1.726 1.108 0.372 0.600 0.400 N 1.201 Z: 22 33.046 2.289 0.645 0.862 0.952 0.667 CA 1.477 22 residues pruned to eliminate duplicates Z: 42 38.474 2.453 0.575 0.595 0.878 0.732 CB 1.617 42 residues pruned to eliminate duplicates Z: 29 25.553 2.420 0.430 0.532 0.821 0.679 CA 1.647 29 residues pruned to eliminate duplicates Z: 22 39.341 2.142 0.800 0.934 1.000 0.952 CB 1.554 22 residues pruned to eliminate duplicates Z: 6 2.824 1.843 0.029 0.396 0.800 0.400 CA 0.929 6 residues pruned to eliminate duplicates Z: 56 34.635 2.235 0.716 0.519 0.873 0.673 CB 1.369 56 residues pruned to eliminate duplicates Z: 69 53.862 2.567 0.649 0.533 0.838 0.662 CB 1.782 63 residues pruned to eliminate duplicates Z: 28 25.616 2.419 0.579 0.391 0.889 0.481 CB 1.630 19 residues pruned to eliminate duplicates Z: 38 67.471 2.599 1.139 0.720 0.919 0.459 CA 1.780 38 residues pruned to eliminate duplicates Z: 6 2.593 1.791 0.539 0.286 0.600 0.400 CB 0.893 6 residues pruned to eliminate duplicates Z: 8 7.733 2.272 0.406 0.368 0.714 0.429 CB 1.476 6 residues pruned to eliminate duplicates Z: 19 32.891 2.026 0.886 0.855 0.944 0.556 CB 1.584 19 residues pruned to eliminate duplicates Z: 18 45.097 2.534 0.741 0.909 1.000 0.706 CA 1.760 18 residues pruned to eliminate duplicates Z: 9 17.840 2.117 0.469 0.878 1.000 0.875 CA 1.472 9 residues pruned to eliminate duplicates Z: 18 30.229 2.196 0.918 0.825 0.941 0.529 CA 1.395 18 residues pruned to eliminate duplicates Z: 8 10.568 2.115 0.587 0.565 0.857 0.571 CB 1.304 8 residues pruned to eliminate duplicates Z: 8 11.337 1.994 0.659 0.699 0.857 0.857 CB 1.260 8 residues pruned to eliminate duplicates Z: 20 39.613 2.310 1.089 0.902 0.947 0.789 CA 1.417 20 residues pruned to eliminate duplicates Z: 18 14.938 2.563 0.265 0.875 1.000 0.882 CA 0.812 18 residues pruned to eliminate duplicates Z: 7 12.514 2.170 0.018 0.831 1.000 0.500 CA 1.738 7 residues pruned to eliminate duplicates Z: 21 13.565 2.103 0.428 0.235 0.900 0.350 CB 1.527 21 residues pruned to eliminate duplicates Z: 47 52.096 2.505 0.732 0.535 0.957 0.565 CB 1.788 47 residues pruned to eliminate duplicates Z: 20 33.527 2.319 0.576 0.785 0.947 0.789 CA 1.727 20 residues pruned to eliminate duplicates Z: 99 56.248 2.498 0.547 0.418 0.898 0.500 CB 1.783 99 residues pruned to eliminate duplicates Z: 7 5.226 1.864 0.143 0.433 1.000 0.333 CB 1.073 Z: 7 4.122 1.693 0.163 0.464 0.833 0.500 CA 1.064 Z: 20 31.302 2.676 0.467 0.864 0.947 0.789 CA 1.416 20 residues pruned to eliminate duplicates Z: 62 55.632 2.630 0.649 0.477 0.951 0.672 CA 1.768 62 residues pruned to eliminate duplicates Z: 41 39.839 2.480 0.639 0.652 0.950 0.725 CA 1.416 41 residues pruned to eliminate duplicates Z: 12 3.811 1.807 0.064 0.316 0.636 0.273 CB 1.152 6 residues pruned to eliminate duplicates Z: 11 6.545 1.758 0.397 0.467 0.800 0.600 CB 1.089 Z: 35 63.245 2.750 1.207 0.655 0.882 0.588 CA 1.753 35 residues pruned to eliminate duplicates Z: 9 22.017 2.150 0.954 0.904 1.000 0.875 CB 1.320 8 residues pruned to eliminate duplicates Z: 39 34.782 2.535 0.565 0.381 0.921 0.526 CB 1.753 39 residues pruned to eliminate duplicates Z: 72 62.806 2.479 0.757 0.589 0.930 0.676 CB 1.691 72 residues pruned to eliminate duplicates Z: 61 44.918 2.494 0.603 0.497 0.883 0.600 CB 1.647 61 residues pruned to eliminate duplicates Z: 20 37.931 2.489 0.805 0.848 1.000 0.737 CA 1.437 20 residues pruned to eliminate duplicates Z: 17 25.007 2.003 0.730 0.915 1.000 0.750 CA 1.275 17 residues pruned to eliminate duplicates Z: 6 5.051 2.033 0.562 0.335 0.600 0.400 CB 1.420 Z: 7 3.030 1.778 0.983 0.445 0.500 0.333 C 0.743 7 residues pruned to eliminate duplicates Z: 24 48.277 2.318 1.135 0.911 0.957 0.696 CA 1.508 24 residues pruned to eliminate duplicates Z: 8 11.190 1.771 0.805 0.878 1.000 0.714 CB 0.961 8 residues pruned to eliminate duplicates Z: 31 27.785 2.514 0.512 0.426 0.900 0.667 CB 1.601 31 residues pruned to eliminate duplicates Z: 19 51.524 2.543 1.158 0.946 1.000 0.556 CA 1.530 19 residues pruned to eliminate duplicates Z: 98 58.792 2.592 0.588 0.444 0.907 0.639 CB 1.694 98 residues pruned to eliminate duplicates Z: 103 63.676 2.493 0.654 0.479 0.892 0.598 CB 1.750 103 residues pruned to eliminate duplicates Z: 100 60.183 2.506 0.625 0.440 0.909 0.556 CB 1.739 100 residues pruned to eliminate duplicates Z: 8 15.087 2.338 0.555 0.803 0.857 0.571 CB 1.405 8 residues pruned to eliminate duplicates Z: 13 7.217 1.895 0.473 0.326 0.750 0.583 CB 1.205 Z: 19 35.354 2.226 0.648 0.902 1.000 0.889 CB 1.621 19 residues pruned to eliminate duplicates Z: 10 4.084 1.465 0.261 0.461 0.889 0.444 CB 0.863 Z: 10 11.711 1.829 0.385 0.769 0.889 0.444 CA 1.367 10 residues pruned to eliminate duplicates Z: 33 29.357 2.607 0.522 0.426 0.812 0.469 CB 1.738 33 residues pruned to eliminate duplicates Z: 7 4.976 2.058 -0.067 0.457 0.833 0.667 N 1.327 Z: 17 28.582 2.251 0.869 0.543 0.938 0.750 CB 1.738 17 residues pruned to eliminate duplicates Z: 9 16.115 2.069 0.783 0.848 1.000 0.875 CB 1.145 9 residues pruned to eliminate duplicates Z: 9 10.903 2.064 0.313 0.854 1.000 0.875 CA 1.051 9 residues pruned to eliminate duplicates Z: 10 3.264 1.735 0.880 0.087 0.444 0.111 CB 1.278 Z: 9 4.452 1.576 0.348 0.394 0.875 0.625 CB 0.947 8 residues pruned to eliminate duplicates Z: 7 5.526 1.919 0.069 0.702 1.000 0.833 CB 0.915 7 residues pruned to eliminate duplicates Z: 7 15.131 2.356 0.150 0.857 1.000 1.000 CA 1.681 7 residues pruned to eliminate duplicates Z: 19 47.194 2.576 0.930 0.915 1.000 0.722 CA 1.582 19 residues pruned to eliminate duplicates Z: 13 21.728 2.104 0.733 0.820 0.917 0.583 CA 1.421 13 residues pruned to eliminate duplicates Z: 8 12.350 1.809 0.552 0.898 1.000 0.857 CB 1.190 11 residues pruned to eliminate duplicates Z: 16 12.289 2.178 0.509 0.372 0.867 0.467 CB 1.276 16 residues pruned to eliminate duplicates Z: 112 53.930 2.456 0.399 0.485 0.901 0.640 CB 1.678 112 residues pruned to eliminate duplicates Z: 8 13.938 2.188 0.590 0.767 0.857 0.571 CB 1.394 8 residues pruned to eliminate duplicates Z: 25 28.531 2.470 0.607 0.449 0.958 0.625 CB 1.614 25 residues pruned to eliminate duplicates Z: 23 52.793 2.367 1.251 0.918 1.000 0.727 CB 1.490 23 residues pruned to eliminate duplicates Z: 20 30.904 2.121 0.742 0.902 0.947 0.789 CB 1.445 20 residues pruned to eliminate duplicates Z: 18 38.514 2.397 0.776 0.874 1.000 0.529 CA 1.596 18 residues pruned to eliminate duplicates Z: 8 28.910 2.516 1.116 0.789 1.000 0.571 CA 1.592 8 residues pruned to eliminate duplicates Z: 9 5.007 1.787 0.918 0.726 0.875 0.375 CB 0.481 9 residues pruned to eliminate duplicates Z: 33 26.647 2.234 0.440 0.519 0.875 0.562 CA 1.642 33 residues pruned to eliminate duplicates Z: 13 8.838 2.097 0.818 0.449 0.583 0.333 CB 1.209 13 residues pruned to eliminate duplicates Z: 11 9.601 1.982 0.355 0.456 0.800 0.400 CB 1.478 Z: 13 21.792 2.079 0.524 0.863 1.000 0.917 CA 1.457 13 residues pruned to eliminate duplicates Z: 10 3.947 1.821 0.346 0.286 0.889 0.444 CB 0.768 Z: 24 29.843 2.278 0.631 0.885 0.957 0.913 CA 1.264 24 residues pruned to eliminate duplicates Z: 82 79.839 2.659 0.887 0.562 0.889 0.630 CA 1.874 82 residues pruned to eliminate duplicates Z: 20 40.474 2.500 0.720 0.903 0.947 0.895 CA 1.625 20 residues pruned to eliminate duplicates Z: 85 56.342 2.443 0.582 0.484 0.940 0.655 CB 1.719 85 residues pruned to eliminate duplicates Z: 92 87.118 2.619 0.922 0.626 0.901 0.538 CB 1.789 92 residues pruned to eliminate duplicates Z: 122 102.717 2.653 0.882 0.611 0.917 0.661 CA 1.835 122 residues pruned to eliminate duplicates Z: 8 5.334 1.873 0.427 0.469 0.857 0.429 CB 0.909 Z: 58 63.656 2.611 0.835 0.679 0.860 0.526 CA 1.737 58 residues pruned to eliminate duplicates Z: 145 116.182 2.633 0.919 0.612 0.958 0.604 CB 1.797 145 residues pruned to eliminate duplicates Z: 8 19.576 2.223 1.137 0.878 0.857 0.714 CA 1.319 8 residues pruned to eliminate duplicates Z: 8 21.637 2.038 0.665 0.864 1.000 0.857 CA 1.767 10 residues pruned to eliminate duplicates Z: 61 29.510 2.324 0.590 0.387 0.833 0.583 CB 1.395 61 residues pruned to eliminate duplicates Z: 26 71.835 2.582 1.381 0.924 0.960 0.680 CA 1.709 26 residues pruned to eliminate duplicates Z: 10 19.850 2.202 0.368 0.853 1.000 0.667 CA 1.623 10 residues pruned to eliminate duplicates Z: 19 36.097 2.120 0.809 0.900 1.000 0.778 CB 1.584 19 residues pruned to eliminate duplicates 6 0.379 1.601 0.477 0.767 1.000 1.000 CB 0.057 ? Z: 10 13.147 2.176 0.515 0.468 0.889 0.667 CB 1.544 10 residues pruned to eliminate duplicates Z: 20 13.823 1.993 0.490 0.304 0.842 0.474 CB 1.576 Z: 19 22.832 1.936 0.618 0.847 1.000 0.833 CA 1.276 19 residues pruned to eliminate duplicates Z: 10 13.960 2.093 0.494 0.762 0.778 0.556 N 1.517 10 residues pruned to eliminate duplicates Z: 8 12.784 2.055 0.770 0.867 0.857 0.429 CB 1.134 8 residues pruned to eliminate duplicates Z: 41 44.543 2.536 0.617 0.549 0.950 0.625 CA 1.724 41 residues pruned to eliminate duplicates Z: 6 2.373 1.589 0.375 0.533 0.800 0.600 CB 0.588 Z: 17 24.596 2.227 0.594 0.836 0.938 0.562 CB 1.383 17 residues pruned to eliminate duplicates Z: 6 9.315 1.571 0.557 0.803 1.000 1.000 N 1.307 6 residues pruned to eliminate duplicates Z: 20 30.153 2.539 0.851 0.626 0.947 0.789 CA 1.379 11 residues pruned to eliminate duplicates Z: 91 88.403 2.590 1.014 0.625 0.922 0.567 CB 1.722 91 residues pruned to eliminate duplicates Z: 7 5.065 1.780 0.386 0.314 0.667 0.333 C 1.545 7 residues pruned to eliminate duplicates Z: 13 8.043 2.237 0.659 0.455 0.750 0.500 CB 0.873 Z: 8 2.543 1.785 0.566 0.486 0.714 0.429 CB 0.488 Z: 9 13.680 2.218 0.276 0.870 0.875 0.875 CA 1.426 9 residues pruned to eliminate duplicates Z: 114 91.799 2.642 0.886 0.599 0.885 0.619 CA 1.782 114 residues pruned to eliminate duplicates Z: 19 6.861 1.824 0.340 0.312 0.722 0.444 CB 1.128 19 residues pruned to eliminate duplicates Z: 12 25.630 2.322 0.630 0.798 0.909 0.727 CB 1.731 12 residues pruned to eliminate duplicates Z: 25 32.348 2.770 0.483 0.897 0.958 0.875 CA 1.201 25 residues pruned to eliminate duplicates Z: 134 99.243 2.611 0.823 0.595 0.917 0.632 CA 1.800 134 residues pruned to eliminate duplicates Z: 17 14.816 2.224 0.439 0.372 0.812 0.625 CB 1.633 17 residues pruned to eliminate duplicates Z: 17 19.058 1.843 0.845 0.876 0.938 0.562 CB 1.086 17 residues pruned to eliminate duplicates Z: 36 26.585 2.310 0.703 0.346 0.857 0.400 CA 1.575 36 residues pruned to eliminate duplicates Z: 88 47.092 2.417 0.503 0.462 0.931 0.632 CB 1.551 88 residues pruned to eliminate duplicates Z: 13 13.386 2.144 0.235 0.590 1.000 0.750 CB 1.339 13 residues pruned to eliminate duplicates Z: 54 32.171 2.165 0.615 0.559 0.925 0.642 CB 1.291 54 residues pruned to eliminate duplicates Z: 22 28.153 2.542 0.912 0.366 0.810 0.524 CA 1.803 22 residues pruned to eliminate duplicates Z: 11 13.863 2.094 0.565 0.628 0.900 0.800 CA 1.318 11 residues pruned to eliminate duplicates Z: 25 22.368 2.381 0.583 0.425 0.917 0.667 CB 1.428 25 residues pruned to eliminate duplicates Z: 10 4.779 1.823 0.197 0.307 0.778 0.333 CB 1.163 Z: 40 37.039 2.369 0.732 0.472 0.949 0.615 CB 1.568 40 residues pruned to eliminate duplicates Z: 12 17.319 1.764 0.878 0.872 0.818 0.727 C 1.404 12 residues pruned to eliminate duplicates 7 1.395 1.481 -0.086 0.245 0.500 0.500 CB 1.130 ? Z: 19 22.663 2.121 0.596 0.896 1.000 0.889 CA 1.130 19 residues pruned to eliminate duplicates Z: 12 9.016 1.883 0.399 0.537 0.727 0.455 CB 1.368 Z: 7 3.599 1.964 -0.081 0.360 0.667 0.500 CB 1.419 Z: 8 15.350 2.647 0.441 0.334 0.857 0.571 CA 2.128 8 residues pruned to eliminate duplicates Z: 33 34.166 2.466 0.749 0.503 0.812 0.656 CB 1.719 33 residues pruned to eliminate duplicates Z: 13 12.946 1.767 0.448 0.778 0.917 0.667 CA 1.246 11 residues pruned to eliminate duplicates Z: 23 34.062 2.246 0.955 0.889 0.864 0.682 CA 1.379 23 residues pruned to eliminate duplicates Z: 50 45.680 2.471 0.553 0.599 0.939 0.694 CA 1.648 50 residues pruned to eliminate duplicates Z: 20 33.493 2.254 0.363 0.925 1.000 0.895 CB 1.755 20 residues pruned to eliminate duplicates Z: 41 31.667 2.422 0.510 0.388 0.850 0.500 CB 1.814 41 residues pruned to eliminate duplicates Z: 37 31.797 2.436 0.532 0.413 0.917 0.611 CB 1.697 49 residues pruned to eliminate duplicates Z: 25 14.980 2.321 0.083 0.389 0.750 0.333 CB 1.825 25 residues pruned to eliminate duplicates Z: 18 40.128 2.427 0.678 0.862 0.941 0.706 CA 1.864 18 residues pruned to eliminate duplicates Z: 36 30.462 2.362 0.402 0.508 0.971 0.657 CB 1.588 36 residues pruned to eliminate duplicates Z: 71 60.385 2.568 0.633 0.580 0.914 0.714 CA 1.743 71 residues pruned to eliminate duplicates Z: 45 45.681 2.445 0.631 0.551 0.932 0.545 CB 1.764 45 residues pruned to eliminate duplicates Z: 7 5.965 1.781 0.326 0.643 0.833 0.667 CB 1.082 Z: 9 5.305 1.952 0.048 0.337 1.000 0.750 CA 1.095 9 residues pruned to eliminate duplicates Z: 6 5.371 2.070 0.540 0.252 0.800 0.400 CB 1.252 Z: 6 4.889 1.981 -0.121 0.513 1.000 0.800 CA 1.239 Z: 18 11.070 2.140 0.480 0.418 0.765 0.471 CB 1.208 18 residues pruned to eliminate duplicates Z: 17 19.875 2.292 0.590 0.410 0.938 0.562 CB 1.599 17 residues pruned to eliminate duplicates Z: 24 23.007 2.437 0.453 0.395 0.957 0.739 CB 1.583 24 residues pruned to eliminate duplicates Z: 16 25.463 2.405 1.071 0.550 0.867 0.733 CB 1.450 16 residues pruned to eliminate duplicates Z: 9 9.238 2.305 0.484 0.622 0.750 0.500 CB 1.134 9 residues pruned to eliminate duplicates Z: 18 28.397 2.110 0.859 0.872 0.882 0.588 CA 1.450 18 residues pruned to eliminate duplicates Z: 15 33.349 2.154 0.739 0.863 1.000 0.571 N 1.746 15 residues pruned to eliminate duplicates Z: 59 64.797 2.484 0.903 0.655 0.914 0.397 CB 1.705 59 residues pruned to eliminate duplicates Z: 11 7.481 1.892 0.591 0.451 0.800 0.700 CB 1.033 Z: 17 27.268 2.054 0.832 0.901 1.000 0.875 CB 1.293 17 residues pruned to eliminate duplicates Z: 13 6.152 1.730 0.854 0.345 0.750 0.583 CB 0.873 Z: 64 93.438 2.796 1.206 0.617 0.937 0.635 CA 1.824 64 residues pruned to eliminate duplicates Z: 7 8.606 2.061 0.543 0.667 1.000 0.500 CB 0.947 7 residues pruned to eliminate duplicates Z: 40 41.022 2.648 0.590 0.460 0.872 0.564 CB 1.863 40 residues pruned to eliminate duplicates Z: 7 3.539 1.497 0.621 0.410 0.667 0.333 CB 0.981 Z: 17 9.683 2.139 0.627 0.399 0.688 0.562 CB 1.126 17 residues pruned to eliminate duplicates Z: 72 60.084 2.510 0.746 0.547 0.901 0.563 CA 1.725 72 residues pruned to eliminate duplicates Z: 23 19.868 2.174 0.521 0.365 1.000 0.591 CB 1.480 26 residues pruned to eliminate duplicates Z: 64 56.062 2.450 0.767 0.651 0.921 0.603 CB 1.540 64 residues pruned to eliminate duplicates Z: 23 31.320 2.223 0.728 0.863 0.955 0.636 CA 1.336 23 residues pruned to eliminate duplicates Z: 9 12.062 2.167 0.630 0.727 0.875 0.500 CA 1.125 9 residues pruned to eliminate duplicates Z: 25 30.529 2.467 0.922 0.691 0.875 0.875 CA 1.261 25 residues pruned to eliminate duplicates Z: 7 8.356 2.138 0.426 0.758 0.667 0.333 CB 1.334 7 residues pruned to eliminate duplicates Z: 45 47.399 2.473 0.787 0.507 0.932 0.636 CB 1.724 45 residues pruned to eliminate duplicates Z: 18 18.503 1.854 0.543 0.927 1.000 0.882 CB 1.099 19 residues pruned to eliminate duplicates Z: 52 48.366 2.626 0.582 0.477 0.902 0.549 CB 1.850 52 residues pruned to eliminate duplicates Z: 17 14.030 1.936 0.139 0.909 1.000 1.000 CA 1.129 17 residues pruned to eliminate duplicates Z: 9 3.574 2.054 0.254 0.356 0.500 0.375 N 1.146 Z: 26 49.964 2.583 0.795 0.926 1.000 0.960 CA 1.512 26 residues pruned to eliminate duplicates Z: 22 23.022 2.298 0.753 0.448 0.810 0.429 CB 1.625 22 residues pruned to eliminate duplicates Z: 10 11.158 1.996 0.476 0.680 0.778 0.556 CB 1.374 9 residues pruned to eliminate duplicates Z: 6 2.951 1.507 0.677 0.357 0.600 0.400 N 1.015 Z: 7 5.602 1.849 0.348 0.349 0.833 0.333 CB 1.298 Z: 36 30.604 2.354 0.727 0.535 0.914 0.486 CB 1.345 36 residues pruned to eliminate duplicates Z: 12 16.534 1.750 0.668 0.916 1.000 0.909 CB 1.206 10 residues pruned to eliminate duplicates Z: 17 15.982 2.264 0.636 0.358 0.875 0.750 CA 1.436 17 residues pruned to eliminate duplicates Z: 8 6.229 1.682 0.558 0.400 0.714 0.714 CA 1.396 Z: 21 36.098 2.256 0.572 0.917 1.000 0.850 CA 1.606 21 residues pruned to eliminate duplicates Z: 24 23.211 2.247 0.285 0.661 0.826 0.565 CB 1.748 24 residues pruned to eliminate duplicates Z: 9 19.530 2.350 0.944 0.879 0.750 0.750 CA 1.461 9 residues pruned to eliminate duplicates 7 1.856 1.781 0.754 0.246 0.333 0.333 CB 0.976 ? Z: 22 37.986 2.159 0.767 0.903 1.000 0.857 CA 1.548 21 residues pruned to eliminate duplicates Z: 14 6.304 1.688 0.594 0.313 0.769 0.308 CB 1.040 14 residues pruned to eliminate duplicates Z: 58 51.416 2.408 0.730 0.605 0.930 0.702 CB 1.591 58 residues pruned to eliminate duplicates Z: 19 24.470 2.055 0.633 0.906 0.889 0.667 CA 1.375 19 residues pruned to eliminate duplicates Z: 17 11.760 2.235 0.773 0.301 0.875 0.312 CB 1.058 17 residues pruned to eliminate duplicates Z: 6 4.062 2.109 0.800 0.278 0.600 0.200 CB 1.025 Z: 51 35.144 2.425 0.560 0.411 0.860 0.560 CB 1.678 51 residues pruned to eliminate duplicates Z: 12 16.366 2.220 0.610 0.608 0.909 0.545 CB 1.370 12 residues pruned to eliminate duplicates Z: 24 33.562 2.297 0.777 0.879 0.957 0.826 CA 1.300 24 residues pruned to eliminate duplicates Z: 6 2.320 1.394 0.583 0.299 0.600 0.600 CB 0.981 Z: 214 116.401 2.545 0.846 0.552 0.930 0.610 CB 1.737 214 residues pruned to eliminate duplicates Z: 6 3.131 1.776 -0.050 0.595 0.800 0.600 CB 0.947 Z: 71 56.777 2.540 0.595 0.579 0.929 0.700 CA 1.672 71 residues pruned to eliminate duplicates Z: 19 11.524 2.261 0.513 0.390 0.833 0.500 CB 1.071 19 residues pruned to eliminate duplicates Z: 21 13.419 2.048 0.373 0.319 0.900 0.400 CA 1.447 18 residues pruned to eliminate duplicates Z: 10 16.540 1.918 0.738 0.860 0.889 0.556 CA 1.368 10 residues pruned to eliminate duplicates Z: 12 16.653 2.239 0.298 0.570 0.909 0.727 N 1.777 12 residues pruned to eliminate duplicates Z: 19 57.505 2.445 1.443 0.932 0.944 0.444 CB 1.678 19 residues pruned to eliminate duplicates Z: 25 12.995 2.007 0.428 0.328 0.750 0.417 N 1.490 25 residues pruned to eliminate duplicates Z: 15 15.253 2.140 0.649 0.444 1.000 0.500 CA 1.224 15 residues pruned to eliminate duplicates Z: 45 32.097 2.288 0.648 0.474 0.886 0.523 CB 1.486 45 residues pruned to eliminate duplicates Z: 21 46.512 2.278 1.067 0.929 1.000 0.850 CB 1.545 21 residues pruned to eliminate duplicates Z: 7 7.184 1.918 0.634 0.376 0.833 0.500 N 1.282 7 residues pruned to eliminate duplicates Z: 11 33.596 2.698 0.852 0.860 0.900 0.900 CA 1.737 10 residues pruned to eliminate duplicates Z: 14 4.014 1.853 0.032 0.249 0.769 0.385 CB 1.011 Z: 7 4.993 1.373 0.550 0.714 0.833 0.333 CA 0.947 Z: 34 27.076 2.255 0.656 0.568 0.758 0.515 CB 1.561 34 residues pruned to eliminate duplicates Z: 19 24.085 1.919 0.957 0.919 1.000 0.722 CA 1.066 19 residues pruned to eliminate duplicates Z: 19 28.976 2.023 0.834 0.895 0.889 0.444 CA 1.484 19 residues pruned to eliminate duplicates Z: 47 31.409 2.362 0.451 0.495 0.891 0.565 CB 1.523 47 residues pruned to eliminate duplicates Z: 18 33.974 2.609 0.434 0.794 0.941 0.647 CA 1.809 18 residues pruned to eliminate duplicates Z: 12 29.744 2.139 0.899 0.812 1.000 0.545 CA 1.683 12 residues pruned to eliminate duplicates Z: 41 45.603 2.553 0.700 0.602 0.900 0.450 CB 1.676 41 residues pruned to eliminate duplicates Z: 109 103.841 2.691 0.948 0.643 0.917 0.722 CA 1.820 109 residues pruned to eliminate duplicates Z: 13 37.877 2.274 0.786 0.893 1.000 0.833 CB 1.933 13 residues pruned to eliminate duplicates Z: 7 4.492 1.964 0.000 0.586 0.667 0.667 CB 1.291 7 residues pruned to eliminate duplicates Z: 13 30.738 2.703 1.127 0.875 0.917 0.833 CA 1.224 13 residues pruned to eliminate duplicates 6 1.590 1.406 0.824 0.290 0.600 0.600 N 0.585 ? Z: 13 18.750 2.200 0.682 0.804 0.833 0.667 CA 1.346 11 residues pruned to eliminate duplicates Z: 13 31.548 2.319 0.616 0.814 1.000 0.667 CA 1.851 13 residues pruned to eliminate duplicates Z: 62 48.743 2.514 0.791 0.456 0.902 0.623 CB 1.608 62 residues pruned to eliminate duplicates Z: 11 5.424 1.808 0.709 0.358 0.800 0.300 CB 0.808 Z: 26 15.919 2.242 0.355 0.354 0.880 0.600 CB 1.394 26 residues pruned to eliminate duplicates Z: 19 23.364 2.186 0.544 0.875 0.944 0.833 CA 1.256 19 residues pruned to eliminate duplicates Z: 8 6.724 1.414 0.665 0.799 1.000 0.857 CB 0.831 Z: 7 8.644 2.149 0.723 0.648 0.833 0.833 CB 0.996 7 residues pruned to eliminate duplicates Z: 182 94.157 2.575 0.683 0.502 0.901 0.674 CB 1.789 182 residues pruned to eliminate duplicates Z: 24 66.188 2.726 1.489 0.914 0.913 0.522 CA 1.576 24 residues pruned to eliminate duplicates Z: 19 36.119 2.152 1.090 0.936 0.944 0.444 CA 1.396 19 residues pruned to eliminate duplicates Z: 10 10.986 2.197 0.711 0.443 0.889 0.556 CB 1.162 10 residues pruned to eliminate duplicates Z: 6 5.740 1.898 0.031 0.535 0.800 0.400 CA 1.585 Z: 19 61.755 2.759 0.871 0.917 0.944 0.722 CA 2.107 19 residues pruned to eliminate duplicates Z: 7 2.567 1.748 0.651 0.366 0.667 0.500 CB 0.629 Z: 6 7.618 1.557 1.373 0.435 0.800 0.600 CA 1.233 Z: 60 58.544 2.570 0.721 0.514 0.949 0.525 CB 1.791 60 residues pruned to eliminate duplicates Z: 11 21.543 2.121 0.485 0.904 1.000 0.900 CA 1.540 11 residues pruned to eliminate duplicates Z: 8 10.816 1.992 0.297 0.781 1.000 0.571 CA 1.235 8 residues pruned to eliminate duplicates Z: 67 60.958 2.681 0.662 0.505 0.939 0.636 CB 1.784 67 residues pruned to eliminate duplicates Z: 24 27.215 2.490 0.695 0.424 0.870 0.652 CB 1.673 24 residues pruned to eliminate duplicates Z: 9 13.229 2.230 0.580 0.421 1.000 0.750 CA 1.442 9 residues pruned to eliminate duplicates Z: 14 19.243 1.997 0.314 0.856 1.000 0.846 CA 1.501 14 residues pruned to eliminate duplicates Z: 8 2.800 1.877 0.597 0.195 0.429 0.429 CB 1.185 Z: 10 14.690 2.158 0.611 0.580 0.889 0.778 CB 1.467 10 residues pruned to eliminate duplicates Z: 6 5.723 1.837 0.491 0.465 0.800 0.600 CB 1.210 Z: 14 16.368 2.071 0.731 0.722 1.000 0.769 CA 1.036 14 residues pruned to eliminate duplicates Z: 24 23.777 2.376 0.450 0.470 0.957 0.609 CB 1.552 24 residues pruned to eliminate duplicates Z: 10 6.805 2.006 0.386 0.417 0.778 0.444 CB 1.144 10 residues pruned to eliminate duplicates Z: 10 5.027 1.737 0.459 0.287 0.778 0.333 CB 1.081 10 residues pruned to eliminate duplicates Z: 53 29.158 2.066 0.724 0.541 0.846 0.635 CB 1.289 53 residues pruned to eliminate duplicates Z: 10 6.942 2.283 0.163 0.490 0.778 0.667 CB 1.132 11 residues pruned to eliminate duplicates Z: 87 58.322 2.482 0.636 0.437 0.895 0.593 CB 1.845 87 residues pruned to eliminate duplicates Z: 21 24.723 1.896 0.922 0.819 0.850 0.650 CA 1.353 21 residues pruned to eliminate duplicates Z: 18 13.008 2.364 0.381 0.377 0.706 0.294 CB 1.561 18 residues pruned to eliminate duplicates Z: 13 18.697 2.302 0.614 0.918 1.000 0.833 CA 1.024 13 residues pruned to eliminate duplicates Z: 99 92.164 2.621 0.924 0.607 0.898 0.673 CA 1.857 99 residues pruned to eliminate duplicates Z: 24 30.191 2.454 0.759 0.448 0.957 0.652 CB 1.609 24 residues pruned to eliminate duplicates Z: 146 103.406 2.613 0.854 0.592 0.938 0.614 CB 1.731 146 residues pruned to eliminate duplicates Z: 102 52.575 2.414 0.515 0.428 0.921 0.594 CB 1.673 102 residues pruned to eliminate duplicates Z: 7 15.637 2.384 0.567 0.751 1.000 0.333 CB 1.366 7 residues pruned to eliminate duplicates Z: 7 3.395 1.896 0.202 0.245 0.667 0.333 CB 1.224 Z: 6 8.022 1.500 0.988 0.623 1.000 0.400 C 1.071 Z: 20 20.605 2.401 0.519 0.369 0.895 0.421 CB 1.667 20 residues pruned to eliminate duplicates Z: 61 66.246 2.493 0.987 0.612 0.917 0.467 CB 1.694 61 residues pruned to eliminate duplicates Z: 8 11.067 2.419 0.154 0.675 1.000 0.571 CB 1.275 8 residues pruned to eliminate duplicates Z: 22 54.227 2.214 1.379 0.920 1.000 0.857 CB 1.582 22 residues pruned to eliminate duplicates 6 1.119 1.878 -0.006 0.465 1.000 0.800 CB 0.278 ? Z: 14 16.748 1.844 0.604 0.874 1.000 0.615 CB 1.143 14 residues pruned to eliminate duplicates Z: 10 17.904 2.142 0.466 0.682 1.000 0.667 CA 1.607 10 residues pruned to eliminate duplicates Z: 9 4.658 1.872 0.516 0.349 1.000 0.625 CB 0.683 9 residues pruned to eliminate duplicates Z: 42 40.068 2.381 0.690 0.509 0.902 0.561 CB 1.707 41 residues pruned to eliminate duplicates Z: 6 3.643 1.992 -0.032 0.644 1.000 0.800 CA 0.739 Z: 7 5.663 1.647 0.896 0.753 1.000 0.500 CB 0.591 Z: 20 20.385 2.223 0.008 0.825 1.000 0.684 CB 1.575 20 residues pruned to eliminate duplicates Z: 13 17.541 2.252 0.412 0.906 1.000 0.917 CA 1.132 13 residues pruned to eliminate duplicates Z: 86 75.604 2.717 0.676 0.499 0.953 0.682 CB 1.892 86 residues pruned to eliminate duplicates Z: 73 52.017 2.465 0.657 0.443 0.903 0.556 CB 1.763 22 residues pruned to eliminate duplicates Z: 6 2.795 1.577 0.476 0.603 0.800 0.600 CB 0.609 Z: 149 92.276 2.525 0.794 0.579 0.905 0.554 CB 1.713 149 residues pruned to eliminate duplicates Z: 21 47.384 2.151 1.169 0.944 1.000 0.900 CB 1.573 21 residues pruned to eliminate duplicates Z: 6 3.292 1.380 0.306 0.757 0.800 0.600 C 0.812 6 residues pruned to eliminate duplicates Z: 24 27.080 2.406 0.399 0.688 0.913 0.739 CA 1.545 24 residues pruned to eliminate duplicates Z: 16 12.157 2.184 0.819 0.521 0.667 0.600 CB 1.161 16 residues pruned to eliminate duplicates Z: 12 15.846 2.269 0.636 0.374 0.909 0.636 CA 1.620 12 residues pruned to eliminate duplicates Z: 10 5.613 1.905 0.495 0.440 0.667 0.444 CB 1.048 7 residues pruned to eliminate duplicates Z: 19 28.211 2.324 0.356 0.882 0.944 0.667 CA 1.617 19 residues pruned to eliminate duplicates Z: 14 14.557 2.332 0.513 0.455 0.769 0.462 CB 1.557 14 residues pruned to eliminate duplicates Z: 26 38.920 2.435 0.547 0.695 0.960 0.720 CB 1.801 26 residues pruned to eliminate duplicates Z: 22 42.987 2.359 0.890 0.877 0.952 0.571 CA 1.605 22 residues pruned to eliminate duplicates Z: 7 7.086 1.873 0.912 0.711 0.833 0.500 CA 0.800 Z: 7 4.598 1.968 0.184 0.523 0.833 0.667 CB 0.945 Z: 8 7.198 1.610 0.465 0.719 0.857 0.571 C 1.104 Z: 18 20.003 1.977 0.513 0.899 1.000 0.824 CA 1.159 18 residues pruned to eliminate duplicates Z: 8 3.511 1.873 0.577 0.309 0.571 0.429 CB 0.972 Z: 7 5.106 1.621 0.300 0.389 1.000 0.500 O 1.112 Z: 61 55.196 2.489 0.614 0.629 0.900 0.700 CA 1.745 61 residues pruned to eliminate duplicates Z: 82 95.342 2.648 1.043 0.637 0.951 0.457 CB 1.813 82 residues pruned to eliminate duplicates Z: 7 2.196 1.524 0.119 0.336 0.833 0.667 CB 0.755 Z: 7 7.242 1.714 1.103 0.394 0.833 0.500 CB 1.101 Z: 23 48.485 2.402 1.105 0.939 1.000 0.773 CA 1.421 23 residues pruned to eliminate duplicates Z: 6 4.154 1.603 0.265 0.620 1.000 0.600 CB 0.818 6 residues pruned to eliminate duplicates Z: 7 13.626 2.202 0.842 0.821 0.833 0.833 CA 1.245 7 residues pruned to eliminate duplicates Z: 8 16.051 2.402 0.864 0.705 0.714 0.429 CA 1.574 8 residues pruned to eliminate duplicates Z: 29 15.872 2.225 0.299 0.335 0.786 0.536 CB 1.582 49 residues pruned to eliminate duplicates Z: 6 5.176 1.532 -0.033 0.719 1.000 0.800 CA 1.282 7 residues pruned to eliminate duplicates Z: 14 9.743 2.057 0.413 0.222 0.846 0.462 CB 1.521 Z: 65 35.222 2.364 0.454 0.380 0.906 0.531 CB 1.606 65 residues pruned to eliminate duplicates Z: 16 24.412 2.194 0.692 0.861 0.933 0.800 CA 1.336 16 residues pruned to eliminate duplicates Z: 8 4.111 1.908 0.413 0.365 0.571 0.286 CB 1.166 Z: 38 22.808 2.309 0.524 0.322 0.838 0.486 CB 1.547 38 residues pruned to eliminate duplicates Z: 6 3.976 1.543 1.137 0.728 1.000 0.600 CB 0.439 Z: 9 6.308 1.857 0.493 0.414 0.625 0.625 CB 1.408 9 residues pruned to eliminate duplicates Z: 8 12.178 2.178 0.818 0.842 0.857 0.571 CA 1.011 8 residues pruned to eliminate duplicates Z: 8 15.681 2.409 0.359 0.493 1.000 0.571 CA 1.824 Z: 66 61.858 2.601 0.779 0.568 0.892 0.631 CA 1.739 66 residues pruned to eliminate duplicates Z: 14 26.314 2.455 1.074 0.581 0.923 0.769 CB 1.437 14 residues pruned to eliminate duplicates Z: 16 13.649 2.084 0.664 0.484 0.800 0.600 CB 1.291 Z: 9 28.383 2.427 0.830 0.779 1.000 0.375 CB 1.766 9 residues pruned to eliminate duplicates Z: 71 45.008 2.476 0.632 0.450 0.871 0.600 CB 1.608 71 residues pruned to eliminate duplicates Z: 6 3.073 1.690 0.391 0.300 0.800 0.400 CB 0.913 Z: 9 21.272 1.979 0.812 0.867 1.000 0.625 CB 1.534 12 residues pruned to eliminate duplicates Z: 17 9.794 2.057 0.649 0.260 0.688 0.375 CA 1.382 17 residues pruned to eliminate duplicates 6 1.475 1.401 0.415 0.387 0.400 0.400 CB 0.938 ? Z: 11 4.167 1.653 0.923 0.212 0.500 0.300 CB 1.164 Z: 8 23.833 2.587 0.945 0.863 0.857 0.571 CB 1.532 8 residues pruned to eliminate duplicates Z: 46 48.013 2.515 0.612 0.555 0.933 0.556 CB 1.793 46 residues pruned to eliminate duplicates Z: 8 8.365 1.954 0.313 0.586 1.000 0.714 CB 1.134 Z: 24 27.735 2.159 0.738 0.650 0.957 0.783 CA 1.401 24 residues pruned to eliminate duplicates Z: 11 14.097 1.764 0.691 0.855 0.900 0.600 CA 1.226 11 residues pruned to eliminate duplicates Z: 7 8.751 1.787 0.670 0.476 0.833 0.333 CA 1.472 7 residues pruned to eliminate duplicates Z: 6 6.213 2.029 0.172 0.578 0.800 0.800 CB 1.355 Z: 11 11.867 1.921 0.507 0.460 1.000 0.600 N 1.350 Z: 41 38.859 2.409 0.653 0.570 0.850 0.625 CB 1.697 41 residues pruned to eliminate duplicates Z: 20 11.309 1.933 0.523 0.396 0.842 0.526 CB 1.168 20 residues pruned to eliminate duplicates Z: 11 10.331 1.897 0.752 0.481 0.800 0.500 CB 1.253 Z: 38 41.314 2.368 0.902 0.613 0.865 0.432 CB 1.567 38 residues pruned to eliminate duplicates Z: 14 9.723 2.048 0.163 0.375 0.923 0.462 CA 1.401 14 residues pruned to eliminate duplicates Z: 12 8.848 2.226 0.196 0.875 0.909 0.818 CB 0.802 12 residues pruned to eliminate duplicates Z: 8 3.606 1.783 0.477 0.215 0.714 0.286 CA 1.013 Z: 48 34.834 2.284 0.522 0.435 0.915 0.553 CB 1.708 48 residues pruned to eliminate duplicates Z: 63 42.872 2.524 0.601 0.470 0.871 0.597 CB 1.594 63 residues pruned to eliminate duplicates Z: 13 16.663 2.074 0.405 0.479 1.000 0.583 CA 1.686 13 residues pruned to eliminate duplicates Z: 9 14.754 2.113 0.402 0.829 1.000 0.750 CB 1.325 9 residues pruned to eliminate duplicates Z: 8 17.302 2.377 0.515 0.705 0.857 0.571 CA 1.758 11 residues pruned to eliminate duplicates Z: 13 22.748 2.188 0.853 0.854 0.750 0.500 N 1.595 13 residues pruned to eliminate duplicates Z: 19 19.329 1.820 0.608 0.916 0.944 0.778 CB 1.163 19 residues pruned to eliminate duplicates Z: 14 17.472 2.303 0.527 0.545 0.846 0.615 CB 1.558 14 residues pruned to eliminate duplicates Z: 10 25.138 2.233 0.544 0.917 1.000 0.778 CA 1.715 10 residues pruned to eliminate duplicates Z: 59 49.073 2.482 0.687 0.588 0.862 0.603 CA 1.640 59 residues pruned to eliminate duplicates Z: 16 16.515 2.459 0.166 0.474 0.933 0.600 CB 1.636 16 residues pruned to eliminate duplicates Z: 6 2.323 1.664 -0.175 0.485 0.800 0.600 N 0.960 Z: 8 2.770 1.425 0.187 0.421 0.857 0.714 N 0.784 Z: 6 4.202 1.595 0.619 0.499 0.800 0.800 CB 0.911 Z: 115 63.879 2.512 0.502 0.502 0.930 0.675 CB 1.702 115 residues pruned to eliminate duplicates Z: 52 47.015 2.536 0.545 0.570 0.922 0.647 CB 1.704 52 residues pruned to eliminate duplicates Z: 10 13.884 2.407 0.198 0.413 1.000 0.667 CA 1.758 10 residues pruned to eliminate duplicates Z: 14 6.073 1.743 0.283 0.265 0.769 0.615 CB 1.280 Z: 17 23.108 2.005 0.768 0.871 0.875 0.625 CB 1.358 26 residues pruned to eliminate duplicates Z: 11 3.371 1.514 0.953 0.150 0.600 0.400 CB 0.925 Z: 22 21.228 2.059 0.670 0.510 0.905 0.714 CB 1.474 22 residues pruned to eliminate duplicates Z: 8 12.003 2.172 0.378 0.620 1.000 1.000 CA 1.354 8 residues pruned to eliminate duplicates Z: 25 13.507 1.679 0.908 0.568 0.875 0.375 CB 0.921 25 residues pruned to eliminate duplicates Z: 8 3.169 1.839 0.713 0.277 0.571 0.286 CB 0.856 8 residues pruned to eliminate duplicates Z: 156 89.515 2.529 0.683 0.517 0.916 0.652 CB 1.814 73 residues pruned to eliminate duplicates Z: 16 41.094 2.418 1.426 0.875 0.867 0.533 CB 1.518 16 residues pruned to eliminate duplicates Z: 6 3.380 1.603 0.236 0.359 0.800 0.600 CA 1.110 Z: 9 9.442 2.134 0.314 0.433 1.000 0.500 CB 1.277 9 residues pruned to eliminate duplicates Z: 9 5.207 2.098 0.576 0.164 0.625 0.625 CB 1.341 9 residues pruned to eliminate duplicates Z: 10 5.743 1.933 -0.162 0.708 0.889 0.667 N 1.101 10 residues pruned to eliminate duplicates Z: 7 6.173 2.228 0.516 0.398 0.833 0.667 CB 0.997 7 residues pruned to eliminate duplicates Z: 7 6.160 1.868 0.525 0.378 1.000 0.500 CB 1.006 Z: 8 9.189 2.032 0.330 0.721 1.000 0.714 CB 1.053 19 residues pruned to eliminate duplicates Z: 7 6.057 1.840 0.703 0.412 0.667 0.500 N 1.297 Z: 54 51.748 2.546 0.771 0.483 0.887 0.660 CB 1.809 54 residues pruned to eliminate duplicates Z: 7 7.403 1.958 0.081 0.527 1.000 0.500 CA 1.390 7 residues pruned to eliminate duplicates Z: 9 8.272 1.948 0.049 0.610 0.875 0.750 CB 1.475 9 residues pruned to eliminate duplicates Z: 7 5.259 1.772 0.121 0.561 1.000 0.667 N 1.019 Z: 17 6.457 1.751 0.418 0.209 0.750 0.375 CB 1.224 Z: 8 8.241 2.094 0.386 0.294 0.857 0.571 N 1.578 8 residues pruned to eliminate duplicates Z: 16 4.813 1.686 0.285 0.233 0.800 0.467 CB 0.978 Z: 74 58.561 2.523 0.639 0.468 0.918 0.658 CB 1.865 74 residues pruned to eliminate duplicates Z: 14 23.556 2.125 0.853 0.838 0.846 0.615 CA 1.466 14 residues pruned to eliminate duplicates Z: 12 23.007 2.171 0.586 0.847 1.000 0.636 CA 1.496 12 residues pruned to eliminate duplicates Z: 6 3.071 1.736 0.613 0.451 0.800 0.600 CB 0.645 Z: 17 15.541 1.891 0.677 0.913 0.875 0.875 CB 0.991 17 residues pruned to eliminate duplicates Z: 18 15.846 1.805 0.755 0.859 0.882 0.824 CB 1.012 18 residues pruned to eliminate duplicates Z: 19 16.132 1.865 0.418 0.919 1.000 0.944 CB 1.013 18 residues pruned to eliminate duplicates Z: 78 44.396 2.492 0.583 0.410 0.909 0.610 CB 1.551 78 residues pruned to eliminate duplicates Z: 7 7.661 1.845 0.918 0.391 0.833 0.500 CB 1.191 Z: 7 4.370 1.554 0.450 0.537 1.000 0.833 N 0.764 Z: 18 21.191 2.214 0.614 0.646 0.882 0.471 CA 1.422 18 residues pruned to eliminate duplicates Z: 7 7.568 2.093 0.264 0.488 0.833 0.500 CA 1.419 7 residues pruned to eliminate duplicates Z: 19 26.745 2.273 0.739 0.558 0.944 0.611 CB 1.596 19 residues pruned to eliminate duplicates Z: 8 3.278 1.703 0.586 0.460 0.571 0.286 CB 0.836 Z: 16 19.541 2.027 0.436 0.931 1.000 1.000 CA 1.212 16 residues pruned to eliminate duplicates Z: 125 76.059 2.501 0.729 0.560 0.895 0.573 CB 1.664 125 residues pruned to eliminate duplicates Z: 7 2.065 1.448 0.077 0.240 0.833 0.333 C 0.877 Z: 7 5.539 1.913 0.141 0.349 0.833 0.500 N 1.464 7 residues pruned to eliminate duplicates Z: 8 17.410 2.089 0.948 0.856 1.000 0.714 CA 1.193 8 residues pruned to eliminate duplicates Z: 41 30.122 2.328 0.528 0.469 0.875 0.525 CB 1.579 41 residues pruned to eliminate duplicates Z: 6 2.747 1.347 0.052 0.795 1.000 0.800 N 0.669 Z: 43 24.820 2.378 0.372 0.331 0.881 0.476 CB 1.604 43 residues pruned to eliminate duplicates Z: 12 22.685 2.150 0.462 0.804 0.909 0.545 CA 1.835 12 residues pruned to eliminate duplicates Z: 63 49.912 2.579 0.480 0.519 0.952 0.645 CB 1.712 63 residues pruned to eliminate duplicates Z: 23 26.053 2.273 0.390 0.901 1.000 0.955 CA 1.255 23 residues pruned to eliminate duplicates 6 1.738 1.197 0.960 0.528 0.600 0.600 N 0.537 ? Z: 6 17.089 2.328 1.077 0.756 1.000 0.800 CA 1.259 6 residues pruned to eliminate duplicates Z: 34 37.230 2.014 1.060 0.716 0.939 0.576 CB 1.367 64 residues pruned to eliminate duplicates Z: 6 4.031 1.471 0.765 0.412 0.800 0.400 N 0.952 Z: 30 22.192 2.237 0.931 0.325 0.793 0.414 CB 1.457 30 residues pruned to eliminate duplicates Z: 7 4.811 1.752 1.126 0.668 0.833 0.833 CB 0.542 Z: 6 2.046 1.330 -0.096 0.482 1.000 0.600 O 0.775 Z: 8 6.428 2.225 -0.084 0.546 1.000 0.571 CB 1.139 Z: 32 39.726 2.388 0.897 0.587 0.935 0.645 CB 1.548 32 residues pruned to eliminate duplicates Z: 53 50.559 2.515 0.818 0.484 0.865 0.519 CB 1.800 53 residues pruned to eliminate duplicates Z: 17 15.476 2.040 0.552 0.503 0.875 0.750 CB 1.393 17 residues pruned to eliminate duplicates Z: 6 3.481 1.511 0.238 0.293 0.800 0.800 CB 1.312 Z: 14 44.784 2.762 1.095 0.895 0.923 0.846 CA 1.666 14 residues pruned to eliminate duplicates Z: 19 52.470 2.624 0.740 0.922 1.000 0.833 CA 1.904 18 residues pruned to eliminate duplicates Z: 6 9.443 1.762 0.784 0.688 0.800 0.800 N 1.414 6 residues pruned to eliminate duplicates Z: 105 100.768 2.650 0.990 0.609 0.904 0.606 CA 1.869 105 residues pruned to eliminate duplicates Z: 15 10.002 2.205 0.474 0.271 0.857 0.357 CB 1.244 15 residues pruned to eliminate duplicates Z: 30 20.445 2.169 0.744 0.472 0.828 0.414 CB 1.249 30 residues pruned to eliminate duplicates Z: 8 5.141 1.616 0.699 0.649 0.857 0.571 CB 0.719 Z: 9 10.455 2.223 0.599 0.641 0.750 0.625 CA 1.216 9 residues pruned to eliminate duplicates Z: 20 39.186 2.167 0.958 0.826 0.947 0.632 CA 1.686 20 residues pruned to eliminate duplicates Z: 56 52.695 2.599 0.590 0.559 0.891 0.618 CA 1.823 56 residues pruned to eliminate duplicates Z: 87 69.369 2.493 0.767 0.564 0.930 0.616 CB 1.715 87 residues pruned to eliminate duplicates Z: 32 19.711 2.245 0.537 0.360 0.806 0.452 CB 1.480 32 residues pruned to eliminate duplicates Z: 6 10.112 1.830 1.404 0.472 0.800 0.600 CA 1.322 11 residues pruned to eliminate duplicates Z: 11 17.182 1.814 0.641 0.878 1.000 0.800 CB 1.325 Z: 9 6.666 2.271 0.169 0.444 0.875 0.625 CB 1.075 9 residues pruned to eliminate duplicates Z: 28 28.111 2.449 0.686 0.390 0.889 0.519 CB 1.655 28 residues pruned to eliminate duplicates Z: 19 37.379 2.522 0.504 0.913 1.000 0.833 CA 1.643 19 residues pruned to eliminate duplicates Z: 6 3.527 1.647 0.201 0.292 0.800 0.600 CB 1.259 7 1.838 1.763 -0.081 0.755 1.000 0.833 CB 0.369 ? Z: 19 37.576 2.224 1.162 0.935 0.944 0.444 CB 1.359 19 residues pruned to eliminate duplicates Z: 6 3.030 1.654 0.419 0.384 0.600 0.600 CB 1.088 Z: 6 3.147 1.562 0.630 0.299 0.600 0.400 O 1.154 Z: 69 61.764 2.581 0.723 0.528 0.941 0.588 CB 1.740 69 residues pruned to eliminate duplicates Z: 10 16.792 1.982 0.725 0.776 0.889 0.778 CA 1.443 10 residues pruned to eliminate duplicates Z: 38 34.343 2.387 0.615 0.551 0.919 0.595 CB 1.517 38 residues pruned to eliminate duplicates Z: 18 21.325 2.348 0.521 0.454 0.941 0.529 CB 1.613 19 residues pruned to eliminate duplicates Z: 33 24.544 2.079 0.652 0.441 0.781 0.562 N 1.718 33 residues pruned to eliminate duplicates Z: 14 7.810 1.921 0.538 0.264 0.769 0.462 CB 1.247 14 residues pruned to eliminate duplicates Z: 10 3.828 1.865 1.395 0.182 0.556 0.222 CB 0.753 Z: 55 45.868 2.560 0.601 0.449 0.926 0.630 CB 1.733 55 residues pruned to eliminate duplicates Z: 36 30.929 2.197 0.936 0.493 0.914 0.600 CB 1.354 36 residues pruned to eliminate duplicates Z: 19 32.136 2.015 1.086 0.873 0.944 0.444 CA 1.390 18 residues pruned to eliminate duplicates Z: 11 5.133 2.063 0.426 0.260 0.900 0.400 CB 0.807 Z: 31 18.451 2.284 0.250 0.422 0.833 0.467 CB 1.537 31 residues pruned to eliminate duplicates Z: 10 4.110 1.721 1.031 0.205 0.667 0.333 CA 0.834 Z: 6 2.391 1.535 -0.141 0.477 1.000 0.800 CB 0.830 Z: 40 78.102 2.798 1.187 0.758 0.923 0.590 CA 1.760 40 residues pruned to eliminate duplicates Z: 7 3.008 1.526 0.542 0.407 1.000 0.667 C 0.575 Z: 7 2.343 1.599 0.419 0.280 0.667 0.333 CB 0.810 Z: 9 4.942 1.511 0.672 0.435 0.750 0.500 N 0.987 Z: 9 3.924 1.816 0.277 0.222 0.750 0.375 CA 1.103 7 residues pruned to eliminate duplicates Z: 7 8.898 2.115 0.275 0.650 1.000 0.833 CA 1.172 7 residues pruned to eliminate duplicates Z: 8 14.966 2.103 0.825 0.629 0.857 0.571 CA 1.523 8 residues pruned to eliminate duplicates Z: 20 32.811 2.432 0.556 0.874 1.000 0.842 CA 1.448 20 residues pruned to eliminate duplicates Z: 10 4.341 1.705 0.084 0.309 0.778 0.222 CB 1.245 Z: 8 2.302 1.531 0.427 0.158 0.571 0.143 C 1.059 Z: 58 47.301 2.419 0.653 0.487 0.930 0.632 CB 1.707 58 residues pruned to eliminate duplicates Z: 8 8.869 2.013 0.499 0.492 0.714 0.571 CA 1.567 8 residues pruned to eliminate duplicates 6 1.474 1.395 0.820 0.335 0.400 0.400 N 0.778 ? Z: 8 5.204 1.942 0.274 0.195 0.857 0.429 CA 1.335 8 residues pruned to eliminate duplicates Z: 12 19.531 2.232 0.464 0.806 0.818 0.818 CB 1.686 12 residues pruned to eliminate duplicates Z: 8 5.778 1.747 0.226 0.336 0.857 0.286 O 1.423 Z: 6 4.919 1.992 -0.238 0.781 1.000 0.800 CB 1.131 Z: 84 78.362 2.702 0.582 0.589 0.928 0.699 CB 1.992 84 residues pruned to eliminate duplicates Z: 200 101.750 2.498 0.676 0.545 0.940 0.678 CB 1.754 199 residues pruned to eliminate duplicates Z: 7 3.828 1.608 0.559 0.319 0.667 0.333 CB 1.142 Z: 38 37.683 2.406 0.539 0.607 0.892 0.730 CB 1.694 38 residues pruned to eliminate duplicates Z: 12 8.164 1.663 0.573 0.423 0.909 0.545 CA 1.121 Using tripeptides from previous cycle as seeds Z: 6 3.949 2.199 0.021 0.472 0.600 0.000 CB 1.349 7 residues pruned to eliminate duplicates Z: 6 3.473 1.625 0.316 0.344 0.800 0.600 CA 1.076 Z: 16 11.047 1.975 0.494 0.273 0.867 0.400 CA 1.443 18 residues pruned to eliminate duplicates Z: 6 3.162 1.866 0.445 0.447 0.600 0.200 CB 0.923 5 residues pruned to eliminate duplicates Z: 6 3.051 1.809 0.895 0.261 0.400 0.200 N 1.308 Z: 6 9.890 1.813 0.776 0.358 1.000 0.600 N 1.602 5 residues pruned to eliminate duplicates Z: 7 3.632 1.714 1.112 0.244 0.833 0.333 CA 0.661 7 residues pruned to eliminate duplicates Z: 8 11.212 2.272 0.703 0.486 0.857 0.714 CA 1.296 8 residues pruned to eliminate duplicates Z: 17 9.616 2.129 0.411 0.441 0.812 0.500 CB 1.046 Z: 7 20.997 2.495 0.740 0.756 1.000 0.667 CA 1.572 17 residues pruned to eliminate duplicates Z: 7 23.514 2.535 0.903 0.782 1.000 0.833 CA 1.552 14 residues pruned to eliminate duplicates Z: 29 15.465 2.128 0.467 0.363 0.857 0.429 CB 1.265 28 residues pruned to eliminate duplicates Z: 6 3.729 1.302 0.425 0.453 1.000 0.600 O 0.943 6 1.496 1.254 0.246 0.256 0.600 0.200 N 0.944 ? Z: 6 6.413 1.870 0.930 0.290 0.800 0.600 CA 1.258 Z: 7 18.518 2.281 0.666 0.829 0.833 0.667 CB 1.797 4 residues pruned to eliminate duplicates Z: 6 4.726 1.547 0.296 0.462 1.000 0.600 O 1.096 6 residues pruned to eliminate duplicates Z: 9 4.669 1.785 0.334 0.334 0.750 0.250 CB 1.107 8 residues pruned to eliminate duplicates Z: 7 6.268 1.824 0.273 0.509 0.833 0.500 CB 1.310 7 residues pruned to eliminate duplicates Z: 19 16.986 2.304 0.379 0.432 1.000 0.556 CB 1.352 19 residues pruned to eliminate duplicates Z: 19 19.002 2.350 0.366 0.450 1.000 0.611 CB 1.468 29 residues pruned to eliminate duplicates Z: 7 9.824 1.833 0.619 0.458 1.000 0.667 N 1.410 7 residues pruned to eliminate duplicates Z: 11 17.553 2.307 0.734 0.483 0.900 0.600 CB 1.569 11 residues pruned to eliminate duplicates Z: 17 12.140 2.287 0.338 0.245 0.812 0.500 CA 1.639 7 residues pruned to eliminate duplicates Z: 6 3.929 1.793 0.679 0.302 0.800 0.200 CB 0.909 7 residues pruned to eliminate duplicates Z: 6 9.871 2.157 0.576 0.462 1.000 0.600 CA 1.350 6 residues pruned to eliminate duplicates Z: 24 12.654 2.000 0.305 0.298 0.913 0.391 CB 1.387 16 residues pruned to eliminate duplicates Z: 7 12.632 2.087 0.677 0.551 0.833 0.167 CA 1.683 7 residues pruned to eliminate duplicates Z: 17 14.193 2.409 0.266 0.276 0.875 0.438 CB 1.714 17 residues pruned to eliminate duplicates Z: 6 3.488 1.480 0.548 0.311 1.000 0.400 N 0.840 Z: 18 13.745 2.240 0.369 0.265 0.882 0.471 CB 1.610 24 residues pruned to eliminate duplicates Z: 7 3.290 1.910 -0.031 0.339 0.667 0.500 CA 1.298 7 residues pruned to eliminate duplicates Z: 21 12.444 2.067 0.324 0.236 0.900 0.500 CB 1.535 21 residues pruned to eliminate duplicates Z: 12 6.049 1.939 0.172 0.351 0.727 0.364 CB 1.296 12 residues pruned to eliminate duplicates Z: 11 6.572 2.111 0.111 0.298 0.700 0.300 CA 1.586 11 residues pruned to eliminate duplicates Z: 12 8.811 2.073 0.155 0.339 0.818 0.455 CB 1.615 13 residues pruned to eliminate duplicates Z: 6 5.407 1.483 0.778 0.506 1.000 0.600 O 0.912 6 residues pruned to eliminate duplicates Z: 7 8.950 2.082 0.492 0.375 0.833 0.333 CB 1.613 13 residues pruned to eliminate duplicates Z: 8 4.256 1.968 0.180 0.579 1.000 0.571 CB 0.642 Z: 7 5.998 2.063 0.357 0.531 0.667 0.500 CB 1.272 8 residues pruned to eliminate duplicates Z: 33 15.601 2.096 0.823 0.394 0.719 0.531 CB 1.124 33 residues pruned to eliminate duplicates Z: 15 8.379 2.106 0.287 0.268 0.714 0.500 CB 1.506 15 residues pruned to eliminate duplicates Z: 70 47.869 2.441 0.618 0.471 0.855 0.652 CB 1.757 70 residues pruned to eliminate duplicates Z: 10 11.056 1.925 0.369 0.448 1.000 0.778 N 1.474 10 residues pruned to eliminate duplicates Z: 10 11.978 1.948 0.584 0.540 0.889 0.444 CB 1.400 9 residues pruned to eliminate duplicates Z: 6 6.192 2.029 0.563 0.351 0.800 0.800 CA 1.282 7 residues pruned to eliminate duplicates Z: 6 3.879 1.512 0.600 0.371 1.000 0.800 CA 0.823 6 residues pruned to eliminate duplicates Z: 22 19.689 2.356 0.606 0.289 0.905 0.571 CB 1.591 22 residues pruned to eliminate duplicates Z: 22 20.235 2.361 0.536 0.316 0.905 0.619 CB 1.648 22 residues pruned to eliminate duplicates Z: 47 33.489 2.351 0.489 0.480 0.891 0.587 CA 1.614 47 residues pruned to eliminate duplicates Z: 23 19.444 2.391 0.573 0.304 0.864 0.545 CB 1.587 23 residues pruned to eliminate duplicates Z: 22 19.180 2.389 0.670 0.311 0.810 0.524 CB 1.598 22 residues pruned to eliminate duplicates Z: 89 62.542 2.524 0.661 0.520 0.909 0.625 CB 1.715 89 residues pruned to eliminate duplicates Z: 80 56.261 2.506 0.665 0.490 0.911 0.595 CB 1.682 80 residues pruned to eliminate duplicates Z: 64 48.854 2.528 0.593 0.487 0.921 0.619 CB 1.683 61 residues pruned to eliminate duplicates Z: 6 7.475 2.001 0.560 0.697 1.000 0.600 CB 0.894 6 residues pruned to eliminate duplicates Z: 100 61.662 2.499 0.567 0.500 0.919 0.687 CA 1.720 100 residues pruned to eliminate duplicates Z: 64 52.673 2.540 0.662 0.489 0.889 0.571 CB 1.788 64 residues pruned to eliminate duplicates Z: 94 63.971 2.574 0.632 0.499 0.903 0.581 CB 1.750 94 residues pruned to eliminate duplicates Z: 40 47.502 2.660 0.699 0.515 0.923 0.590 CB 1.796 40 residues pruned to eliminate duplicates Z: 74 69.562 2.605 0.878 0.541 0.904 0.548 CB 1.768 74 residues pruned to eliminate duplicates Z: 62 46.657 2.515 0.650 0.434 0.934 0.541 CB 1.650 62 residues pruned to eliminate duplicates Z: 78 55.917 2.532 0.684 0.463 0.896 0.636 CB 1.732 78 residues pruned to eliminate duplicates Z: 41 52.825 2.613 0.702 0.493 1.000 0.675 CA 1.891 41 residues pruned to eliminate duplicates Z: 54 46.844 2.615 0.612 0.497 0.868 0.642 CB 1.764 54 residues pruned to eliminate duplicates Z: 54 49.435 2.641 0.679 0.494 0.868 0.547 CB 1.775 54 residues pruned to eliminate duplicates Z: 193 74.856 2.415 0.602 0.465 0.880 0.589 CB 1.643 83 residues pruned to eliminate duplicates Z: 10 17.534 2.235 0.786 0.664 1.000 0.556 CA 1.258 10 residues pruned to eliminate duplicates Z: 49 39.679 2.468 0.743 0.464 0.875 0.542 CB 1.578 49 residues pruned to eliminate duplicates Z: 48 43.087 2.554 0.629 0.469 0.936 0.596 CB 1.666 48 residues pruned to eliminate duplicates Z: 75 55.907 2.510 0.694 0.488 0.919 0.635 CA 1.685 79 residues pruned to eliminate duplicates Z: 7 23.103 2.635 0.591 0.785 1.000 0.833 CA 1.752 Z: 64 55.401 2.609 0.653 0.488 0.937 0.603 CA 1.749 71 residues pruned to eliminate duplicates Z: 48 43.425 2.548 0.642 0.542 0.936 0.617 CB 1.553 48 residues pruned to eliminate duplicates Z: 23 31.746 2.659 0.687 0.405 0.909 0.545 CB 1.833 23 residues pruned to eliminate duplicates Z: 71 54.499 2.529 0.609 0.492 0.929 0.614 CB 1.737 71 residues pruned to eliminate duplicates Z: 40 43.874 2.638 0.678 0.495 0.923 0.590 CB 1.727 40 residues pruned to eliminate duplicates Z: 84 57.365 2.471 0.696 0.489 0.916 0.554 CB 1.660 84 residues pruned to eliminate duplicates Z: 78 51.207 2.515 0.648 0.466 0.883 0.584 CB 1.651 78 residues pruned to eliminate duplicates Z: 88 46.653 2.470 0.535 0.419 0.885 0.586 CB 1.622 88 residues pruned to eliminate duplicates Z: 66 56.391 2.575 0.714 0.539 0.908 0.585 CA 1.681 66 residues pruned to eliminate duplicates Z: 55 46.060 2.566 0.598 0.465 0.926 0.537 CB 1.710 55 residues pruned to eliminate duplicates Z: 68 48.805 2.540 0.634 0.474 0.866 0.582 CB 1.703 68 residues pruned to eliminate duplicates Z: 65 49.429 2.509 0.653 0.510 0.906 0.703 CB 1.629 65 residues pruned to eliminate duplicates Z: 72 63.351 2.595 0.711 0.532 0.944 0.549 CB 1.739 75 residues pruned to eliminate duplicates Z: 6 5.432 2.293 0.045 0.331 0.800 0.400 CB 1.526 6 residues pruned to eliminate duplicates Z: 69 49.346 2.550 0.551 0.472 0.941 0.603 CB 1.654 69 residues pruned to eliminate duplicates Z: 28 32.643 2.551 0.645 0.510 0.926 0.593 CA 1.600 28 residues pruned to eliminate duplicates Z: 28 25.728 2.356 0.565 0.450 0.963 0.630 CA 1.468 28 residues pruned to eliminate duplicates Z: 19 20.043 2.564 0.485 0.503 0.833 0.722 CA 1.484 19 residues pruned to eliminate duplicates Z: 67 52.915 2.592 0.658 0.506 0.879 0.561 CB 1.714 67 residues pruned to eliminate duplicates Z: 81 69.454 2.559 0.658 0.595 0.963 0.675 CB 1.736 81 residues pruned to eliminate duplicates Z: 90 55.193 2.533 0.624 0.446 0.865 0.573 CA 1.737 90 residues pruned to eliminate duplicates Z: 74 61.038 2.574 0.670 0.537 0.918 0.575 CA 1.746 74 residues pruned to eliminate duplicates Z: 68 49.446 2.523 0.652 0.425 0.925 0.507 CB 1.692 68 residues pruned to eliminate duplicates Z: 71 51.326 2.502 0.660 0.466 0.943 0.571 CA 1.621 68 residues pruned to eliminate duplicates Z: 10 27.731 2.728 0.930 0.876 1.000 0.667 CA 1.276 10 residues pruned to eliminate duplicates Z: 72 45.283 2.552 0.509 0.467 0.831 0.592 CA 1.736 72 residues pruned to eliminate duplicates Z: 32 28.207 2.571 0.536 0.473 0.871 0.645 CA 1.514 32 residues pruned to eliminate duplicates Z: 93 55.924 2.550 0.615 0.427 0.902 0.500 CB 1.693 93 residues pruned to eliminate duplicates Z: 24 20.687 2.328 0.477 0.434 0.913 0.696 CA 1.471 24 residues pruned to eliminate duplicates Z: 31 34.180 2.631 0.715 0.508 0.800 0.567 CA 1.715 31 residues pruned to eliminate duplicates Z: 66 52.373 2.526 0.635 0.547 0.923 0.677 CA 1.627 66 residues pruned to eliminate duplicates Z: 73 60.507 2.583 0.713 0.501 0.944 0.611 CB 1.704 73 residues pruned to eliminate duplicates Z: 72 60.799 2.559 0.710 0.496 0.944 0.423 CB 1.754 72 residues pruned to eliminate duplicates Z: 73 49.259 2.440 0.627 0.492 0.889 0.611 CA 1.658 73 residues pruned to eliminate duplicates Z: 38 50.157 2.478 0.968 0.652 0.892 0.622 CA 1.645 38 residues pruned to eliminate duplicates Z: 71 54.956 2.615 0.580 0.513 0.886 0.614 CA 1.772 71 residues pruned to eliminate duplicates Z: 76 63.849 2.559 0.710 0.543 0.907 0.587 CA 1.780 76 residues pruned to eliminate duplicates Z: 62 57.896 2.572 0.708 0.595 0.902 0.656 CA 1.709 62 residues pruned to eliminate duplicates Z: 28 49.649 2.520 1.185 0.663 0.889 0.556 CA 1.678 28 residues pruned to eliminate duplicates Z: 41 39.865 2.618 0.526 0.532 0.875 0.525 CB 1.748 41 residues pruned to eliminate duplicates Z: 62 55.203 2.615 0.628 0.523 0.934 0.541 CA 1.736 62 residues pruned to eliminate duplicates Z: 76 71.889 2.591 0.795 0.602 0.907 0.667 CA 1.786 76 residues pruned to eliminate duplicates Z: 53 53.081 2.611 0.683 0.546 0.904 0.635 CA 1.771 53 residues pruned to eliminate duplicates Z: 41 44.080 2.647 0.586 0.520 0.900 0.500 CB 1.808 41 residues pruned to eliminate duplicates Z: 24 30.556 2.406 0.600 0.631 0.913 0.739 CB 1.602 24 residues pruned to eliminate duplicates Z: 42 38.092 2.585 0.576 0.528 0.854 0.561 CB 1.664 42 residues pruned to eliminate duplicates Z: 68 52.570 2.547 0.644 0.505 0.881 0.612 CB 1.733 68 residues pruned to eliminate duplicates Z: 45 41.477 2.512 0.658 0.489 0.909 0.614 CB 1.670 45 residues pruned to eliminate duplicates Z: 18 27.560 2.424 0.659 0.650 0.882 0.824 CB 1.638 18 residues pruned to eliminate duplicates Z: 54 53.160 2.607 0.670 0.566 0.906 0.604 CB 1.738 54 residues pruned to eliminate duplicates Z: 74 55.945 2.604 0.493 0.580 0.904 0.630 CA 1.725 33 residues pruned to eliminate duplicates Z: 6 5.136 2.002 0.993 0.304 0.600 0.200 CB 1.193 Z: 7 9.449 2.006 0.500 0.598 1.000 0.333 CB 1.168 4 residues pruned to eliminate duplicates Z: 6 12.815 1.917 0.891 0.487 1.000 0.600 N 1.603 15 residues pruned to eliminate duplicates Z: 43 43.344 2.365 0.722 0.553 0.881 0.643 CB 1.770 43 residues pruned to eliminate duplicates Z: 68 70.857 2.564 0.922 0.634 0.910 0.672 CA 1.702 68 residues pruned to eliminate duplicates Z: 49 51.377 2.628 0.625 0.703 0.917 0.812 CA 1.575 49 residues pruned to eliminate duplicates Z: 130 82.679 2.506 0.648 0.613 0.899 0.659 CB 1.761 130 residues pruned to eliminate duplicates Z: 49 61.698 2.613 0.935 0.679 0.958 0.708 CA 1.559 70 residues pruned to eliminate duplicates Z: 93 77.023 2.626 0.678 0.608 0.891 0.652 CB 1.845 93 residues pruned to eliminate duplicates Z: 91 79.837 2.620 0.721 0.632 0.911 0.711 CA 1.810 91 residues pruned to eliminate duplicates Z: 91 80.442 2.624 0.738 0.614 0.933 0.733 CA 1.789 91 residues pruned to eliminate duplicates Z: 89 77.377 2.604 0.744 0.570 0.943 0.670 CB 1.800 89 residues pruned to eliminate duplicates Z: 64 52.884 2.524 0.697 0.646 0.873 0.603 CA 1.555 64 residues pruned to eliminate duplicates Z: 91 84.064 2.608 0.807 0.633 0.922 0.689 CA 1.799 91 residues pruned to eliminate duplicates Z: 92 78.947 2.567 0.752 0.608 0.923 0.615 CB 1.800 92 residues pruned to eliminate duplicates Z: 49 48.109 2.637 0.636 0.700 0.917 0.771 CA 1.463 49 residues pruned to eliminate duplicates Z: 63 74.567 2.689 0.818 0.671 0.919 0.597 CB 1.800 63 residues pruned to eliminate duplicates Z: 89 78.227 2.622 0.772 0.577 0.909 0.568 CB 1.833 89 residues pruned to eliminate duplicates Z: 74 73.457 2.667 0.781 0.619 0.904 0.712 CB 1.789 74 residues pruned to eliminate duplicates Z: 46 68.851 2.696 0.968 0.716 0.933 0.778 CA 1.704 46 residues pruned to eliminate duplicates Z: 91 84.431 2.580 0.830 0.629 0.933 0.644 CB 1.789 91 residues pruned to eliminate duplicates Z: 92 80.710 2.524 1.043 0.612 0.901 0.593 CA 1.638 92 residues pruned to eliminate duplicates Z: 91 82.961 2.565 0.800 0.632 0.933 0.656 CB 1.793 91 residues pruned to eliminate duplicates Z: 91 87.056 2.631 0.886 0.619 0.911 0.556 CB 1.813 91 residues pruned to eliminate duplicates Z: 48 75.606 2.681 1.072 0.706 0.957 0.766 CA 1.719 48 residues pruned to eliminate duplicates Z: 48 71.806 2.668 1.176 0.700 0.936 0.723 CA 1.605 48 residues pruned to eliminate duplicates Z: 71 72.215 2.637 0.835 0.590 0.914 0.586 CB 1.790 71 residues pruned to eliminate duplicates Z: 46 78.931 2.724 1.088 0.727 0.956 0.667 CA 1.764 46 residues pruned to eliminate duplicates Z: 36 66.377 2.727 1.152 0.712 0.914 0.514 CA 1.726 36 residues pruned to eliminate duplicates Z: 94 86.890 2.551 0.950 0.619 0.914 0.634 CB 1.771 94 residues pruned to eliminate duplicates Z: 45 61.529 2.553 1.020 0.688 0.864 0.523 CA 1.754 45 residues pruned to eliminate duplicates Z: 91 84.058 2.607 0.893 0.622 0.900 0.611 CB 1.777 91 residues pruned to eliminate duplicates Z: 75 78.460 2.671 1.005 0.605 0.892 0.568 CB 1.729 75 residues pruned to eliminate duplicates Z: 120 98.131 2.593 0.954 0.596 0.916 0.580 CB 1.769 120 residues pruned to eliminate duplicates Z: 48 67.913 2.660 1.097 0.626 0.936 0.553 CB 1.684 48 residues pruned to eliminate duplicates Z: 91 86.027 2.575 0.877 0.629 0.933 0.578 CB 1.781 91 residues pruned to eliminate duplicates Z: 46 76.867 2.699 1.138 0.724 0.911 0.511 CB 1.781 46 residues pruned to eliminate duplicates Z: 64 77.722 2.605 1.044 0.663 0.905 0.603 CB 1.748 64 residues pruned to eliminate duplicates Z: 91 90.373 2.638 0.892 0.628 0.922 0.544 CB 1.835 91 residues pruned to eliminate duplicates Z: 47 69.296 2.689 1.159 0.660 0.891 0.609 CB 1.703 47 residues pruned to eliminate duplicates Z: 90 89.850 2.624 0.957 0.638 0.933 0.539 CB 1.747 90 residues pruned to eliminate duplicates Z: 40 61.659 2.707 1.045 0.666 0.897 0.692 CB 1.705 40 residues pruned to eliminate duplicates Z: 38 67.753 2.644 1.230 0.639 0.946 0.595 CA 1.753 38 residues pruned to eliminate duplicates Z: 90 90.417 2.624 0.985 0.621 0.921 0.539 CB 1.781 90 residues pruned to eliminate duplicates Z: 35 74.430 2.659 1.451 0.734 0.912 0.500 CB 1.741 35 residues pruned to eliminate duplicates Z: 70 75.327 2.604 0.935 0.606 0.899 0.551 CB 1.811 70 residues pruned to eliminate duplicates Z: 112 88.418 2.514 0.986 0.604 0.919 0.550 CB 1.658 112 residues pruned to eliminate duplicates Z: 92 92.785 2.623 0.953 0.625 0.945 0.516 CB 1.786 92 residues pruned to eliminate duplicates Z: 46 72.424 2.664 1.183 0.719 0.911 0.533 CB 1.672 46 residues pruned to eliminate duplicates Z: 123 85.374 2.485 0.804 0.614 0.910 0.582 CB 1.702 123 residues pruned to eliminate duplicates Z: 109 68.500 2.488 0.727 0.552 0.861 0.491 CB 1.694 109 residues pruned to eliminate duplicates Z: 74 74.840 2.663 1.016 0.610 0.877 0.521 CB 1.676 74 residues pruned to eliminate duplicates Z: 73 74.743 2.577 0.847 0.590 0.931 0.542 CB 1.824 73 residues pruned to eliminate duplicates Z: 108 75.758 2.512 0.724 0.596 0.907 0.636 CB 1.703 108 residues pruned to eliminate duplicates Z: 94 84.724 2.598 0.862 0.617 0.935 0.581 CB 1.738 94 residues pruned to eliminate duplicates Z: 46 50.511 2.553 0.745 0.550 0.911 0.511 CB 1.767 46 residues pruned to eliminate duplicates Z: 20 23.766 2.511 0.543 0.458 0.895 0.421 CB 1.641 20 residues pruned to eliminate duplicates Z: 123 85.876 2.512 0.822 0.586 0.893 0.639 CB 1.751 123 residues pruned to eliminate duplicates Z: 91 90.733 2.622 0.963 0.628 0.911 0.533 CB 1.809 91 residues pruned to eliminate duplicates Z: 89 83.797 2.591 0.991 0.578 0.909 0.580 CB 1.767 89 residues pruned to eliminate duplicates Z: 83 61.154 2.437 0.688 0.587 0.878 0.634 CB 1.721 83 residues pruned to eliminate duplicates Z: 28 40.008 2.608 0.867 0.503 0.889 0.667 CB 1.774 28 residues pruned to eliminate duplicates Z: 74 74.102 2.668 0.904 0.598 0.904 0.589 CB 1.719 74 residues pruned to eliminate duplicates Z: 47 46.418 2.489 0.672 0.542 0.891 0.630 CB 1.770 47 residues pruned to eliminate duplicates Z: 74 76.431 2.656 0.963 0.606 0.904 0.589 CB 1.716 74 residues pruned to eliminate duplicates Z: 92 86.964 2.633 0.944 0.626 0.890 0.549 CB 1.777 92 residues pruned to eliminate duplicates Z: 71 68.314 2.602 0.991 0.581 0.886 0.557 CB 1.646 71 residues pruned to eliminate duplicates Z: 48 50.853 2.521 0.689 0.520 0.936 0.660 CB 1.823 48 residues pruned to eliminate duplicates Z: 46 50.116 2.556 0.639 0.554 0.933 0.689 CB 1.813 46 residues pruned to eliminate duplicates Z: 46 49.158 2.522 0.652 0.560 0.933 0.622 CB 1.776 46 residues pruned to eliminate duplicates Z: 118 94.209 2.543 0.884 0.609 0.940 0.615 CB 1.744 118 residues pruned to eliminate duplicates Z: 47 47.157 2.496 0.747 0.526 0.848 0.522 CA 1.832 47 residues pruned to eliminate duplicates Z: 46 50.079 2.567 0.748 0.548 0.867 0.622 CB 1.831 46 residues pruned to eliminate duplicates Z: 46 50.701 2.523 0.756 0.550 0.911 0.644 CB 1.784 46 residues pruned to eliminate duplicates Z: 82 62.724 2.441 0.714 0.573 0.914 0.654 CB 1.699 82 residues pruned to eliminate duplicates Z: 29 33.302 2.612 0.678 0.467 0.857 0.536 CB 1.732 29 residues pruned to eliminate duplicates Z: 83 50.962 2.408 0.516 0.551 0.866 0.634 CB 1.694 83 residues pruned to eliminate duplicates Z: 46 49.441 2.524 0.700 0.554 0.889 0.622 CB 1.834 46 residues pruned to eliminate duplicates Z: 47 52.432 2.534 0.688 0.536 0.935 0.652 CB 1.866 47 residues pruned to eliminate duplicates Z: 46 49.006 2.564 0.648 0.552 0.889 0.622 CB 1.848 46 residues pruned to eliminate duplicates Z: 93 86.184 2.616 0.925 0.610 0.891 0.630 CB 1.803 93 residues pruned to eliminate duplicates Z: 81 62.292 2.457 0.671 0.574 0.913 0.637 CB 1.730 81 residues pruned to eliminate duplicates Z: 22 33.541 2.356 0.727 0.576 0.905 0.667 CB 1.848 22 residues pruned to eliminate duplicates Z: 21 31.971 2.347 0.642 0.621 0.900 0.700 CB 1.840 21 residues pruned to eliminate duplicates Z: 83 78.161 2.620 0.846 0.591 0.927 0.585 CB 1.765 83 residues pruned to eliminate duplicates Z: 91 80.886 2.622 0.855 0.609 0.900 0.578 CB 1.756 91 residues pruned to eliminate duplicates Z: 94 85.370 2.577 0.898 0.594 0.935 0.581 CB 1.768 94 residues pruned to eliminate duplicates Z: 48 41.974 2.484 0.614 0.500 0.872 0.638 CB 1.750 48 residues pruned to eliminate duplicates Z: 81 81.192 2.631 0.843 0.607 0.925 0.575 CB 1.829 81 residues pruned to eliminate duplicates Z: 48 47.092 2.523 0.719 0.518 0.894 0.638 CB 1.740 48 residues pruned to eliminate duplicates Z: 58 50.498 2.365 0.652 0.619 0.912 0.737 CB 1.677 58 residues pruned to eliminate duplicates Z: 69 63.353 2.591 0.828 0.599 0.838 0.574 CB 1.760 69 residues pruned to eliminate duplicates Z: 47 48.872 2.530 0.655 0.522 0.935 0.630 CB 1.801 47 residues pruned to eliminate duplicates Z: 112 88.282 2.547 0.833 0.616 0.901 0.613 CB 1.785 112 residues pruned to eliminate duplicates Z: 119 90.014 2.513 0.775 0.604 0.941 0.636 CB 1.788 119 residues pruned to eliminate duplicates Z: 68 50.194 2.492 0.589 0.493 0.910 0.493 CB 1.713 68 residues pruned to eliminate duplicates Z: 82 60.223 2.470 0.604 0.572 0.914 0.617 CB 1.725 82 residues pruned to eliminate duplicates Z: 35 25.626 2.252 0.641 0.386 0.853 0.618 CB 1.574 35 residues pruned to eliminate duplicates Z: 58 43.319 2.354 0.480 0.593 0.877 0.684 CB 1.718 58 residues pruned to eliminate duplicates Z: 110 75.924 2.541 0.856 0.551 0.862 0.541 CB 1.702 110 residues pruned to eliminate duplicates Z: 76 45.550 2.397 0.547 0.493 0.840 0.573 CB 1.701 76 residues pruned to eliminate duplicates Z: 122 86.208 2.545 0.800 0.593 0.901 0.636 CB 1.738 122 residues pruned to eliminate duplicates Z: 127 90.725 2.526 0.829 0.622 0.897 0.643 CB 1.740 127 residues pruned to eliminate duplicates Z: 124 79.931 2.508 0.723 0.570 0.902 0.577 CB 1.726 124 residues pruned to eliminate duplicates Z: 82 53.617 2.412 0.613 0.557 0.877 0.691 CB 1.652 82 residues pruned to eliminate duplicates Z: 127 90.522 2.562 0.751 0.622 0.913 0.643 CB 1.756 127 residues pruned to eliminate duplicates Z: 40 42.700 2.345 0.766 0.598 0.923 0.744 CB 1.629 40 residues pruned to eliminate duplicates Z: 118 85.055 2.543 0.788 0.593 0.915 0.607 CB 1.731 118 residues pruned to eliminate duplicates Z: 83 57.573 2.443 0.603 0.561 0.927 0.646 CB 1.651 83 residues pruned to eliminate duplicates Z: 46 36.067 2.361 0.445 0.531 0.867 0.667 CB 1.765 46 residues pruned to eliminate duplicates Z: 128 84.728 2.538 0.785 0.611 0.882 0.583 CB 1.694 128 residues pruned to eliminate duplicates Z: 46 41.140 2.329 0.589 0.536 0.911 0.556 CB 1.755 46 residues pruned to eliminate duplicates Z: 126 90.525 2.515 0.896 0.616 0.896 0.616 CB 1.697 126 residues pruned to eliminate duplicates Z: 72 48.495 2.445 0.549 0.504 0.887 0.634 CB 1.705 72 residues pruned to eliminate duplicates Z: 108 76.699 2.501 0.730 0.597 0.935 0.673 CB 1.671 108 residues pruned to eliminate duplicates Z: 106 76.974 2.541 0.737 0.597 0.895 0.629 CB 1.734 106 residues pruned to eliminate duplicates Z: 128 71.151 2.478 0.746 0.534 0.858 0.583 CB 1.645 128 residues pruned to eliminate duplicates Z: 57 49.632 2.352 0.704 0.603 0.875 0.643 CB 1.714 57 residues pruned to eliminate duplicates Z: 87 55.303 2.432 0.596 0.542 0.884 0.547 CB 1.669 87 residues pruned to eliminate duplicates Z: 36 41.760 2.398 0.592 0.638 0.943 0.771 CB 1.723 36 residues pruned to eliminate duplicates Z: 84 61.931 2.454 0.763 0.548 0.880 0.627 CB 1.704 84 residues pruned to eliminate duplicates Z: 82 68.167 2.473 0.775 0.586 0.926 0.617 CB 1.716 82 residues pruned to eliminate duplicates Z: 133 89.716 2.483 0.872 0.603 0.917 0.553 CB 1.661 133 residues pruned to eliminate duplicates Z: 118 89.900 2.543 0.900 0.616 0.915 0.590 CB 1.686 118 residues pruned to eliminate duplicates Z: 149 85.671 2.491 0.814 0.562 0.899 0.581 CB 1.633 149 residues pruned to eliminate duplicates Z: 38 45.425 2.348 0.850 0.620 0.946 0.622 CB 1.623 38 residues pruned to eliminate duplicates Z: 82 66.833 2.457 0.820 0.581 0.914 0.617 CB 1.683 82 residues pruned to eliminate duplicates Z: 127 91.672 2.522 0.959 0.616 0.905 0.675 CB 1.638 127 residues pruned to eliminate duplicates Z: 150 84.577 2.477 0.837 0.562 0.886 0.564 CB 1.618 150 residues pruned to eliminate duplicates Z: 58 52.573 2.352 0.710 0.624 0.912 0.596 CB 1.688 58 residues pruned to eliminate duplicates Z: 127 99.622 2.548 0.954 0.615 0.921 0.603 CB 1.737 127 residues pruned to eliminate duplicates Z: 41 41.920 2.335 0.760 0.585 0.925 0.575 CB 1.607 41 residues pruned to eliminate duplicates Z: 24 32.232 2.335 0.589 0.811 0.913 0.739 CB 1.513 24 residues pruned to eliminate duplicates Z: 15 21.310 2.256 0.506 0.754 0.857 0.714 CA 1.560 15 residues pruned to eliminate duplicates Z: 29 30.956 2.167 0.730 0.711 0.893 0.786 CB 1.443 23 residues pruned to eliminate duplicates Z: 23 30.517 2.204 0.443 0.880 0.955 0.864 CB 1.553 28 residues pruned to eliminate duplicates Z: 23 35.793 2.207 0.609 0.865 1.000 0.682 CB 1.574 23 residues pruned to eliminate duplicates Z: 24 28.435 2.240 0.575 0.768 0.957 0.739 CB 1.386 24 residues pruned to eliminate duplicates Z: 26 30.158 2.223 0.673 0.730 0.920 0.680 CB 1.434 26 residues pruned to eliminate duplicates Z: 24 34.301 2.244 1.053 0.771 0.870 0.739 CB 1.405 24 residues pruned to eliminate duplicates Z: 24 34.574 2.284 0.891 0.758 0.913 0.696 CB 1.454 24 residues pruned to eliminate duplicates Z: 24 41.763 2.302 1.128 0.770 0.913 0.565 CB 1.532 24 residues pruned to eliminate duplicates Z: 23 42.788 2.193 1.215 0.879 0.864 0.545 CB 1.577 23 residues pruned to eliminate duplicates Z: 35 31.727 2.260 0.813 0.638 0.824 0.529 CB 1.417 35 residues pruned to eliminate duplicates Z: 23 41.003 2.352 0.975 0.821 0.909 0.727 CB 1.567 23 residues pruned to eliminate duplicates Z: 26 40.641 2.298 1.125 0.727 0.880 0.600 CB 1.542 26 residues pruned to eliminate duplicates Z: 24 39.500 2.286 1.104 0.789 0.913 0.696 CB 1.454 24 residues pruned to eliminate duplicates Z: 23 38.871 2.287 1.197 0.801 0.864 0.591 CB 1.469 23 residues pruned to eliminate duplicates Z: 22 52.917 2.329 1.202 0.915 1.000 0.619 CB 1.592 22 residues pruned to eliminate duplicates Z: 23 53.758 2.249 1.195 0.913 1.000 0.773 CB 1.644 23 residues pruned to eliminate duplicates Z: 22 53.552 2.361 1.246 0.918 0.952 0.619 CB 1.632 23 residues pruned to eliminate duplicates Z: 6 3.450 1.564 0.110 0.483 0.800 0.800 N 1.130 Z: 7 5.837 1.570 0.139 0.521 1.000 0.833 N 1.305 6 residues pruned to eliminate duplicates Z: 23 32.056 2.507 0.451 0.805 0.909 0.636 CA 1.583 31 residues pruned to eliminate duplicates Z: 34 32.640 2.347 0.680 0.556 0.848 0.515 CB 1.608 34 residues pruned to eliminate duplicates Z: 23 48.320 2.683 0.818 0.748 1.000 0.727 CA 1.693 23 residues pruned to eliminate duplicates Z: 22 50.099 2.716 0.775 0.798 1.000 0.619 CA 1.748 22 residues pruned to eliminate duplicates Z: 27 48.356 2.558 0.953 0.653 0.885 0.577 CB 1.862 27 residues pruned to eliminate duplicates Z: 23 61.004 2.690 1.119 0.756 0.955 0.773 CA 1.904 23 residues pruned to eliminate duplicates Z: 29 42.511 2.510 0.818 0.626 0.857 0.571 CB 1.825 29 residues pruned to eliminate duplicates Z: 24 48.774 2.605 1.030 0.718 0.870 0.652 CB 1.815 24 residues pruned to eliminate duplicates Z: 26 47.677 2.511 1.166 0.677 0.840 0.760 CA 1.773 26 residues pruned to eliminate duplicates Z: 27 54.564 2.583 1.217 0.675 0.962 0.615 CB 1.655 21 residues pruned to eliminate duplicates Z: 17 54.467 2.423 1.421 0.906 1.000 0.625 CA 1.651 22 residues pruned to eliminate duplicates Z: 19 57.279 2.585 1.401 0.898 0.889 0.389 CA 1.751 19 residues pruned to eliminate duplicates Z: 24 46.938 2.605 1.011 0.676 0.870 0.478 CA 1.827 24 residues pruned to eliminate duplicates Z: 23 49.932 2.676 1.100 0.756 0.818 0.455 CB 1.843 23 residues pruned to eliminate duplicates Z: 23 53.465 2.666 1.021 0.765 0.909 0.364 CB 1.840 23 residues pruned to eliminate duplicates Z: 25 43.474 2.574 1.094 0.718 0.875 0.208 CB 1.544 25 residues pruned to eliminate duplicates Z: 23 38.036 2.521 0.867 0.717 0.864 0.273 CB 1.639 23 residues pruned to eliminate duplicates Z: 31 38.176 2.330 1.039 0.553 0.833 0.267 CA 1.673 31 residues pruned to eliminate duplicates Z: 25 54.299 2.580 1.172 0.731 0.917 0.333 CB 1.753 22 residues pruned to eliminate duplicates Z: 21 56.925 2.603 1.255 0.840 0.900 0.500 CA 1.797 21 residues pruned to eliminate duplicates Z: 111 71.051 2.509 0.640 0.492 0.927 0.600 CB 1.790 111 residues pruned to eliminate duplicates Z: 8 6.830 2.177 0.419 0.261 0.857 0.143 CA 1.282 8 residues pruned to eliminate duplicates Z: 6 5.639 2.037 0.539 0.329 0.800 0.000 CB 1.212 6 residues pruned to eliminate duplicates Z: 36 36.626 2.319 0.540 0.546 0.914 0.543 CA 1.812 36 residues pruned to eliminate duplicates Z: 29 39.005 2.458 0.473 0.682 0.929 0.643 CB 1.854 30 residues pruned to eliminate duplicates Z: 6 3.578 1.756 0.387 0.299 0.800 0.800 CA 1.028 6 residues pruned to eliminate duplicates Z: 31 35.668 2.359 0.542 0.591 0.967 0.700 CB 1.697 31 residues pruned to eliminate duplicates Z: 31 31.323 2.312 0.444 0.601 0.900 0.600 CB 1.728 31 residues pruned to eliminate duplicates Z: 30 37.255 2.360 0.566 0.647 0.931 0.621 CB 1.754 24 residues pruned to eliminate duplicates Z: 20 41.953 2.417 0.543 0.871 1.000 0.895 CA 1.883 20 residues pruned to eliminate duplicates Z: 24 34.831 2.421 0.368 0.765 0.957 0.739 CA 1.812 24 residues pruned to eliminate duplicates Z: 25 37.678 2.454 0.553 0.730 0.917 0.750 CB 1.790 25 residues pruned to eliminate duplicates Z: 36 36.661 2.376 0.490 0.589 0.886 0.629 CA 1.815 36 residues pruned to eliminate duplicates Z: 18 35.544 2.418 0.369 0.882 1.000 0.824 CA 1.885 18 residues pruned to eliminate duplicates Z: 28 32.184 2.403 0.408 0.616 0.926 0.630 CA 1.772 28 residues pruned to eliminate duplicates Z: 36 32.293 2.349 0.359 0.570 0.857 0.600 CB 1.863 36 residues pruned to eliminate duplicates Z: 26 36.097 2.451 0.523 0.705 0.880 0.760 CB 1.824 26 residues pruned to eliminate duplicates Z: 30 30.037 2.454 0.410 0.640 0.759 0.586 CA 1.862 30 residues pruned to eliminate duplicates Z: 25 39.504 2.506 0.497 0.741 0.917 0.708 CB 1.888 25 residues pruned to eliminate duplicates Z: 41 34.459 2.300 0.586 0.546 0.875 0.525 CB 1.632 41 residues pruned to eliminate duplicates Z: 38 33.672 2.302 0.407 0.588 0.892 0.622 CB 1.761 38 residues pruned to eliminate duplicates Z: 33 38.726 2.372 0.582 0.663 0.844 0.750 CB 1.859 32 residues pruned to eliminate duplicates Z: 20 38.179 2.354 0.516 0.871 1.000 0.737 CA 1.789 20 residues pruned to eliminate duplicates Z: 35 33.673 2.340 0.509 0.629 0.853 0.706 CB 1.698 35 residues pruned to eliminate duplicates Z: 32 33.832 2.347 0.619 0.590 0.871 0.581 CB 1.685 32 residues pruned to eliminate duplicates Z: 35 36.008 2.405 0.444 0.628 0.912 0.676 CB 1.729 35 residues pruned to eliminate duplicates Z: 12 8.996 1.994 0.568 0.279 0.818 0.455 CB 1.361 15 residues pruned to eliminate duplicates Z: 6 3.676 1.828 0.773 0.148 0.600 0.000 N 1.305 6 residues pruned to eliminate duplicates Z: 18 15.614 2.116 0.768 0.454 0.824 0.529 CB 1.289 20 residues pruned to eliminate duplicates Z: 6 4.823 1.960 0.032 0.491 1.000 0.400 CA 1.077 6 residues pruned to eliminate duplicates Z: 52 42.414 2.397 0.655 0.443 0.961 0.608 CB 1.652 64 residues pruned to eliminate duplicates Z: 7 7.272 1.498 0.630 0.553 1.000 0.667 N 1.155 7 residues pruned to eliminate duplicates Z: 54 36.161 2.377 0.570 0.382 0.906 0.604 CB 1.666 54 residues pruned to eliminate duplicates Z: 51 39.452 2.383 0.726 0.445 0.880 0.660 CB 1.631 51 residues pruned to eliminate duplicates Z: 53 38.271 2.389 0.569 0.383 0.962 0.577 CB 1.668 52 residues pruned to eliminate duplicates Z: 6 6.918 2.089 0.544 0.342 1.000 0.200 CB 1.139 6 residues pruned to eliminate duplicates Z: 26 21.124 2.235 0.580 0.369 0.920 0.600 CB 1.497 26 residues pruned to eliminate duplicates Z: 52 36.886 2.421 0.596 0.370 0.902 0.510 CB 1.702 52 residues pruned to eliminate duplicates Z: 26 21.481 2.285 0.546 0.324 0.960 0.440 CB 1.538 26 residues pruned to eliminate duplicates Z: 12 15.365 2.080 0.540 0.616 0.818 0.727 CA 1.585 12 residues pruned to eliminate duplicates Z: 106 58.642 2.440 0.647 0.426 0.914 0.610 CB 1.682 106 residues pruned to eliminate duplicates Z: 46 35.082 2.419 0.580 0.391 0.889 0.578 CB 1.727 46 residues pruned to eliminate duplicates Z: 54 34.581 2.360 0.562 0.365 0.906 0.509 CB 1.644 54 residues pruned to eliminate duplicates Z: 25 17.324 2.305 0.380 0.304 0.917 0.417 CB 1.508 25 residues pruned to eliminate duplicates Z: 54 34.932 2.363 0.567 0.362 0.925 0.491 CB 1.626 54 residues pruned to eliminate duplicates Z: 54 41.094 2.394 0.634 0.383 0.962 0.509 CB 1.698 54 residues pruned to eliminate duplicates Z: 10 16.725 2.047 0.369 0.708 1.000 0.778 CB 1.647 10 residues pruned to eliminate duplicates Z: 65 32.777 2.307 0.501 0.397 0.891 0.469 CB 1.481 65 residues pruned to eliminate duplicates Z: 48 37.674 2.452 0.578 0.403 0.936 0.596 CB 1.680 48 residues pruned to eliminate duplicates Z: 98 58.517 2.507 0.605 0.447 0.897 0.649 CB 1.738 98 residues pruned to eliminate duplicates Z: 56 38.258 2.356 0.629 0.411 0.891 0.545 CB 1.656 56 residues pruned to eliminate duplicates Z: 55 39.270 2.370 0.558 0.389 0.944 0.481 CB 1.724 55 residues pruned to eliminate duplicates Z: 53 37.372 2.453 0.543 0.391 0.904 0.577 CB 1.700 53 residues pruned to eliminate duplicates Z: 31 23.656 2.331 0.533 0.376 0.833 0.500 CB 1.656 31 residues pruned to eliminate duplicates Z: 62 35.393 2.293 0.541 0.364 0.934 0.557 CB 1.588 54 residues pruned to eliminate duplicates Z: 7 8.342 2.198 0.530 0.358 0.667 0.667 CB 1.770 7 residues pruned to eliminate duplicates Z: 102 57.516 2.467 0.597 0.418 0.911 0.604 CB 1.737 102 residues pruned to eliminate duplicates Z: 54 32.294 2.348 0.475 0.370 0.887 0.585 CB 1.660 54 residues pruned to eliminate duplicates Z: 102 57.327 2.500 0.623 0.451 0.871 0.545 CB 1.696 102 residues pruned to eliminate duplicates Z: 87 52.549 2.492 0.528 0.412 0.919 0.616 CB 1.776 87 residues pruned to eliminate duplicates Z: 28 35.378 2.445 0.726 0.502 0.926 0.519 CB 1.739 28 residues pruned to eliminate duplicates Z: 74 60.682 2.521 0.641 0.491 0.945 0.644 CB 1.834 74 residues pruned to eliminate duplicates Z: 53 35.999 2.403 0.564 0.397 0.904 0.596 CB 1.638 53 residues pruned to eliminate duplicates Z: 22 19.197 2.202 0.688 0.566 0.762 0.476 CB 1.388 22 residues pruned to eliminate duplicates Z: 17 27.363 2.396 0.655 0.604 0.875 0.688 CB 1.786 17 residues pruned to eliminate duplicates Z: 19 26.690 2.324 0.769 0.544 0.833 0.556 CB 1.759 19 residues pruned to eliminate duplicates Z: 80 65.389 2.522 0.709 0.569 0.911 0.633 CA 1.753 80 residues pruned to eliminate duplicates Z: 53 38.723 2.414 0.628 0.398 0.904 0.615 CB 1.684 53 residues pruned to eliminate duplicates Z: 86 61.305 2.515 0.632 0.448 0.929 0.576 CB 1.839 86 residues pruned to eliminate duplicates Z: 96 54.740 2.494 0.558 0.422 0.916 0.579 CB 1.712 96 residues pruned to eliminate duplicates Z: 93 67.204 2.540 0.630 0.470 0.957 0.587 CB 1.823 93 residues pruned to eliminate duplicates Z: 20 20.590 2.134 0.744 0.485 0.842 0.526 CB 1.531 20 residues pruned to eliminate duplicates Z: 84 54.882 2.518 0.580 0.413 0.916 0.578 CB 1.811 84 residues pruned to eliminate duplicates Z: 98 57.635 2.506 0.558 0.428 0.918 0.608 CB 1.761 98 residues pruned to eliminate duplicates Z: 60 62.665 2.583 0.729 0.551 0.949 0.542 CB 1.831 60 residues pruned to eliminate duplicates Z: 98 57.981 2.513 0.603 0.412 0.918 0.567 CB 1.747 98 residues pruned to eliminate duplicates Z: 101 54.913 2.479 0.565 0.412 0.890 0.530 CB 1.743 101 residues pruned to eliminate duplicates Z: 75 60.400 2.585 0.628 0.479 0.946 0.554 CB 1.801 75 residues pruned to eliminate duplicates Z: 127 76.172 2.485 0.698 0.483 0.921 0.603 CB 1.776 127 residues pruned to eliminate duplicates Z: 99 58.044 2.492 0.548 0.455 0.918 0.582 CB 1.732 99 residues pruned to eliminate duplicates Z: 62 60.535 2.590 0.676 0.539 0.951 0.689 CB 1.808 62 residues pruned to eliminate duplicates Z: 98 56.186 2.521 0.620 0.432 0.876 0.608 CB 1.711 98 residues pruned to eliminate duplicates Z: 61 56.327 2.591 0.649 0.513 0.917 0.600 CA 1.833 61 residues pruned to eliminate duplicates Z: 60 54.991 2.613 0.609 0.520 0.915 0.678 CB 1.825 60 residues pruned to eliminate duplicates Z: 33 38.823 2.687 0.678 0.414 0.906 0.562 CB 1.837 33 residues pruned to eliminate duplicates Z: 62 55.548 2.573 0.660 0.443 0.967 0.623 CB 1.826 62 residues pruned to eliminate duplicates Z: 64 61.727 2.594 0.690 0.517 0.968 0.587 CB 1.801 64 residues pruned to eliminate duplicates Z: 88 60.559 2.539 0.579 0.440 0.943 0.575 CB 1.829 88 residues pruned to eliminate duplicates Z: 97 62.881 2.544 0.618 0.435 0.948 0.594 CB 1.760 97 residues pruned to eliminate duplicates Z: 34 37.286 2.645 0.644 0.422 0.879 0.576 CB 1.844 34 residues pruned to eliminate duplicates Z: 27 27.266 2.565 0.599 0.365 0.846 0.654 CA 1.782 27 residues pruned to eliminate duplicates Z: 93 56.854 2.564 0.564 0.418 0.913 0.576 CB 1.763 93 residues pruned to eliminate duplicates Z: 39 37.168 2.502 0.654 0.421 0.868 0.553 CB 1.822 39 residues pruned to eliminate duplicates Z: 92 52.476 2.463 0.510 0.400 0.934 0.604 CB 1.760 92 residues pruned to eliminate duplicates Z: 94 60.109 2.552 0.683 0.400 0.925 0.548 CB 1.743 94 residues pruned to eliminate duplicates Z: 78 61.613 2.594 0.709 0.462 0.922 0.636 CB 1.785 78 residues pruned to eliminate duplicates Z: 95 55.921 2.517 0.629 0.409 0.904 0.532 CB 1.712 95 residues pruned to eliminate duplicates Z: 117 60.228 2.433 0.650 0.439 0.888 0.534 CB 1.672 117 residues pruned to eliminate duplicates Z: 100 52.104 2.477 0.522 0.378 0.909 0.545 CB 1.740 100 residues pruned to eliminate duplicates Z: 61 59.247 2.610 0.670 0.507 0.950 0.667 CB 1.834 61 residues pruned to eliminate duplicates Z: 34 39.287 2.617 0.765 0.437 0.939 0.515 CB 1.682 34 residues pruned to eliminate duplicates Z: 34 41.268 2.647 0.684 0.436 0.970 0.545 CB 1.776 34 residues pruned to eliminate duplicates Z: 95 62.616 2.520 0.699 0.426 0.947 0.564 CB 1.720 95 residues pruned to eliminate duplicates Z: 14 19.443 2.431 0.724 0.389 0.923 0.692 CB 1.568 14 residues pruned to eliminate duplicates Z: 59 63.601 2.634 0.726 0.517 0.983 0.638 CB 1.838 59 residues pruned to eliminate duplicates Z: 96 58.263 2.532 0.570 0.444 0.937 0.632 CB 1.700 96 residues pruned to eliminate duplicates Z: 98 58.103 2.524 0.594 0.427 0.918 0.619 CB 1.724 98 residues pruned to eliminate duplicates Z: 96 62.622 2.526 0.684 0.434 0.916 0.632 CB 1.767 96 residues pruned to eliminate duplicates Z: 34 35.597 2.669 0.612 0.447 0.909 0.455 CB 1.674 34 residues pruned to eliminate duplicates Z: 33 37.032 2.665 0.617 0.394 0.969 0.469 CB 1.753 33 residues pruned to eliminate duplicates Z: 16 26.498 2.758 0.591 0.423 1.000 0.533 CB 1.689 16 residues pruned to eliminate duplicates Z: 18 21.999 2.618 0.535 0.376 0.941 0.353 CB 1.610 18 residues pruned to eliminate duplicates Z: 32 37.997 2.663 0.585 0.464 0.935 0.419 CB 1.793 32 residues pruned to eliminate duplicates Z: 101 57.381 2.473 0.565 0.415 0.950 0.520 CB 1.706 101 residues pruned to eliminate duplicates Z: 22 15.801 2.381 0.486 0.303 0.810 0.429 CB 1.499 22 residues pruned to eliminate duplicates Z: 119 86.520 2.604 0.772 0.570 0.890 0.627 CA 1.812 146 residues pruned to eliminate duplicates Z: 12 27.792 2.446 0.863 0.893 0.909 0.636 CB 1.452 12 residues pruned to eliminate duplicates Z: 67 57.582 2.524 0.639 0.613 0.879 0.636 CA 1.752 67 residues pruned to eliminate duplicates Z: 60 73.783 2.643 0.858 0.633 0.915 0.644 CB 1.886 60 residues pruned to eliminate duplicates Z: 54 61.374 2.659 0.665 0.680 0.925 0.660 CA 1.744 54 residues pruned to eliminate duplicates Z: 16 22.013 2.580 0.728 0.610 0.800 0.533 CA 1.436 16 residues pruned to eliminate duplicates Z: 66 55.256 2.567 0.619 0.635 0.877 0.631 CA 1.657 66 residues pruned to eliminate duplicates Z: 49 62.632 2.696 0.887 0.730 0.938 0.750 CA 1.541 49 residues pruned to eliminate duplicates Z: 69 62.529 2.549 0.854 0.639 0.868 0.603 CA 1.624 69 residues pruned to eliminate duplicates Z: 94 68.427 2.518 0.751 0.561 0.925 0.634 CA 1.640 94 residues pruned to eliminate duplicates Z: 58 68.712 2.665 0.792 0.673 0.912 0.702 CA 1.781 58 residues pruned to eliminate duplicates Z: 53 67.106 2.670 0.877 0.685 0.923 0.692 CA 1.697 53 residues pruned to eliminate duplicates Z: 62 58.355 2.571 0.746 0.622 0.869 0.590 CA 1.707 62 residues pruned to eliminate duplicates Z: 65 52.208 2.559 0.628 0.670 0.859 0.609 CA 1.558 65 residues pruned to eliminate duplicates Z: 73 66.138 2.548 0.679 0.602 0.903 0.597 CB 1.831 73 residues pruned to eliminate duplicates Z: 67 55.685 2.545 0.613 0.632 0.924 0.606 CA 1.596 67 residues pruned to eliminate duplicates Z: 50 56.379 2.580 0.863 0.596 0.898 0.612 CA 1.703 50 residues pruned to eliminate duplicates Z: 63 63.170 2.541 0.886 0.615 0.871 0.468 CA 1.724 63 residues pruned to eliminate duplicates Z: 130 87.274 2.574 0.728 0.572 0.884 0.558 CB 1.824 130 residues pruned to eliminate duplicates Z: 50 62.573 2.624 0.807 0.576 0.939 0.531 CA 1.867 50 residues pruned to eliminate duplicates Z: 60 64.650 2.605 0.915 0.625 0.847 0.610 CB 1.770 60 residues pruned to eliminate duplicates Z: 49 63.353 2.614 0.975 0.601 0.875 0.521 CA 1.839 49 residues pruned to eliminate duplicates Z: 67 66.614 2.568 0.791 0.656 0.909 0.530 CA 1.696 67 residues pruned to eliminate duplicates Z: 55 78.676 2.632 1.050 0.699 0.926 0.500 CA 1.787 55 residues pruned to eliminate duplicates Z: 35 67.381 2.733 1.004 0.738 0.941 0.529 CA 1.812 35 residues pruned to eliminate duplicates Z: 55 68.329 2.578 0.955 0.624 0.907 0.593 CB 1.808 55 residues pruned to eliminate duplicates Z: 39 47.426 2.557 0.921 0.557 0.868 0.500 CB 1.706 39 residues pruned to eliminate duplicates Z: 75 67.649 2.561 0.841 0.610 0.865 0.527 CB 1.737 84 residues pruned to eliminate duplicates Z: 38 51.174 2.525 0.880 0.585 0.892 0.270 CB 1.832 38 residues pruned to eliminate duplicates Z: 35 57.357 2.611 1.000 0.626 0.912 0.324 CB 1.835 35 residues pruned to eliminate duplicates Z: 64 64.288 2.504 0.912 0.610 0.841 0.492 CB 1.812 64 residues pruned to eliminate duplicates Z: 34 49.346 2.591 0.961 0.605 0.848 0.303 CB 1.803 34 residues pruned to eliminate duplicates Z: 13 55.642 2.680 1.566 0.835 0.917 0.500 CB 1.909 13 residues pruned to eliminate duplicates Z: 42 40.792 2.462 0.841 0.578 0.780 0.390 CB 1.670 42 residues pruned to eliminate duplicates Z: 56 75.345 2.617 1.012 0.666 0.927 0.382 CB 1.784 56 residues pruned to eliminate duplicates Z: 53 63.432 2.505 0.999 0.610 0.885 0.365 CA 1.790 53 residues pruned to eliminate duplicates Z: 47 62.263 2.635 0.917 0.622 0.913 0.435 CB 1.774 47 residues pruned to eliminate duplicates Z: 57 72.081 2.670 0.910 0.659 0.875 0.589 CA 1.862 57 residues pruned to eliminate duplicates Z: 49 74.466 2.667 1.054 0.711 0.917 0.542 CA 1.767 49 residues pruned to eliminate duplicates Z: 88 77.767 2.648 0.818 0.597 0.862 0.563 CB 1.832 88 residues pruned to eliminate duplicates Z: 49 77.281 2.609 1.084 0.669 0.917 0.396 CB 1.915 49 residues pruned to eliminate duplicates Z: 58 68.208 2.648 0.897 0.644 0.860 0.456 CB 1.828 58 residues pruned to eliminate duplicates Z: 28 24.295 2.394 0.650 0.403 0.815 0.444 CB 1.609 28 residues pruned to eliminate duplicates Z: 37 46.240 2.542 0.936 0.597 0.861 0.556 CB 1.658 37 residues pruned to eliminate duplicates Z: 51 52.963 2.513 0.956 0.597 0.820 0.320 CB 1.694 51 residues pruned to eliminate duplicates Z: 34 46.962 2.585 1.050 0.645 0.788 0.333 CB 1.710 34 residues pruned to eliminate duplicates Z: 60 67.918 2.625 0.969 0.663 0.847 0.458 CB 1.735 60 residues pruned to eliminate duplicates Z: 37 29.057 2.365 0.664 0.476 0.833 0.389 CB 1.513 37 residues pruned to eliminate duplicates Z: 59 73.614 2.654 0.943 0.647 0.879 0.483 CA 1.858 59 residues pruned to eliminate duplicates Z: 60 62.600 2.633 0.798 0.615 0.898 0.508 CB 1.719 60 residues pruned to eliminate duplicates Z: 44 50.406 2.523 0.805 0.641 0.860 0.512 CB 1.718 44 residues pruned to eliminate duplicates Z: 19 15.403 2.227 0.578 0.500 0.833 0.333 CB 1.240 19 residues pruned to eliminate duplicates Z: 11 9.057 2.316 0.780 0.368 0.600 0.300 CB 1.333 11 residues pruned to eliminate duplicates Z: 57 59.124 2.534 0.933 0.590 0.839 0.500 CB 1.764 57 residues pruned to eliminate duplicates Z: 39 33.696 2.477 0.728 0.487 0.763 0.395 CB 1.695 39 residues pruned to eliminate duplicates Z: 50 49.720 2.500 0.774 0.602 0.837 0.469 CB 1.737 50 residues pruned to eliminate duplicates Z: 20 15.850 2.256 0.539 0.478 0.789 0.526 CB 1.357 20 residues pruned to eliminate duplicates Z: 22 16.577 2.248 0.458 0.385 0.810 0.476 CB 1.541 22 residues pruned to eliminate duplicates Z: 49 57.412 2.633 0.823 0.609 0.854 0.417 CA 1.823 49 residues pruned to eliminate duplicates Z: 52 42.641 2.518 0.674 0.569 0.824 0.529 CB 1.610 52 residues pruned to eliminate duplicates Z: 16 15.921 2.394 0.386 0.531 0.733 0.667 CB 1.640 16 residues pruned to eliminate duplicates Z: 35 19.950 2.350 0.460 0.408 0.765 0.559 CB 1.436 35 residues pruned to eliminate duplicates Z: 16 17.369 2.296 0.432 0.540 0.800 0.733 CB 1.641 16 residues pruned to eliminate duplicates Z: 70 42.363 2.379 0.651 0.460 0.855 0.536 CB 1.581 63 residues pruned to eliminate duplicates Z: 7 6.842 2.209 -0.020 0.593 0.833 0.667 CA 1.417 7 residues pruned to eliminate duplicates Z: 28 19.376 2.322 0.224 0.344 0.926 0.667 CB 1.679 28 residues pruned to eliminate duplicates Z: 31 17.874 2.324 0.333 0.318 0.767 0.400 CB 1.680 31 residues pruned to eliminate duplicates Z: 25 16.521 2.465 0.082 0.338 0.833 0.375 CA 1.812 25 residues pruned to eliminate duplicates Z: 26 19.718 2.395 0.193 0.340 0.960 0.520 CB 1.711 26 residues pruned to eliminate duplicates Z: 26 16.585 2.460 0.148 0.336 0.800 0.440 CB 1.757 26 residues pruned to eliminate duplicates Z: 22 21.874 2.482 0.353 0.423 0.857 0.476 CB 1.795 22 residues pruned to eliminate duplicates Z: 15 13.286 2.313 0.424 0.280 0.857 0.643 CB 1.611 15 residues pruned to eliminate duplicates Z: 21 16.329 2.341 0.330 0.293 0.850 0.400 CB 1.740 21 residues pruned to eliminate duplicates Z: 26 17.619 2.422 0.202 0.322 0.880 0.440 CB 1.672 26 residues pruned to eliminate duplicates Z: 32 19.155 2.221 0.306 0.354 0.871 0.581 CA 1.595 32 residues pruned to eliminate duplicates Z: 27 17.158 2.410 0.155 0.320 0.846 0.385 CB 1.742 27 residues pruned to eliminate duplicates Z: 28 18.807 2.357 0.325 0.338 0.852 0.407 CB 1.624 28 residues pruned to eliminate duplicates Z: 24 19.742 2.529 0.283 0.373 0.826 0.478 CB 1.760 24 residues pruned to eliminate duplicates Z: 20 16.440 2.433 0.284 0.352 0.789 0.526 CB 1.795 20 residues pruned to eliminate duplicates Z: 28 14.280 2.216 0.356 0.303 0.704 0.519 CB 1.618 28 residues pruned to eliminate duplicates Z: 25 23.220 2.431 0.426 0.366 0.917 0.542 CB 1.723 25 residues pruned to eliminate duplicates Z: 14 12.602 2.224 0.669 0.246 0.769 0.692 CA 1.640 14 residues pruned to eliminate duplicates Z: 25 20.242 2.488 0.350 0.338 0.792 0.542 CA 1.855 25 residues pruned to eliminate duplicates Z: 20 16.505 2.373 0.446 0.307 0.842 0.526 CB 1.625 20 residues pruned to eliminate duplicates Z: 10 15.486 2.363 0.626 0.360 0.889 0.889 CA 1.758 Z: 14 24.021 2.554 0.589 0.619 0.846 0.615 CA 1.734 14 residues pruned to eliminate duplicates Z: 220 121.850 2.637 0.768 0.535 0.927 0.644 CB 1.841 220 residues pruned to eliminate duplicates Z: 57 55.427 2.604 0.616 0.549 0.964 0.607 CB 1.740 57 residues pruned to eliminate duplicates Z: 90 63.585 2.476 0.637 0.554 0.933 0.573 CB 1.692 90 residues pruned to eliminate duplicates Z: 65 42.998 2.473 0.553 0.485 0.906 0.578 CB 1.568 65 residues pruned to eliminate duplicates Z: 104 56.578 2.498 0.633 0.431 0.903 0.592 CB 1.624 104 residues pruned to eliminate duplicates Z: 85 58.375 2.575 0.615 0.476 0.917 0.560 CB 1.711 85 residues pruned to eliminate duplicates Z: 13 8.620 2.416 0.518 0.356 0.667 0.417 CB 1.189 13 residues pruned to eliminate duplicates Z: 45 44.931 2.620 0.702 0.476 0.909 0.636 CB 1.712 45 residues pruned to eliminate duplicates Z: 13 10.363 2.312 0.434 0.314 0.917 0.750 CB 1.210 13 residues pruned to eliminate duplicates Z: 31 39.242 2.653 0.611 0.495 0.933 0.467 CB 1.805 31 residues pruned to eliminate duplicates Z: 98 56.419 2.561 0.545 0.439 0.928 0.577 CB 1.663 98 residues pruned to eliminate duplicates Z: 77 61.341 2.595 0.752 0.470 0.895 0.618 CB 1.784 77 residues pruned to eliminate duplicates Z: 54 44.589 2.539 0.670 0.443 0.962 0.566 CB 1.592 54 residues pruned to eliminate duplicates Z: 211 107.297 2.585 0.721 0.519 0.905 0.695 CA 1.805 211 residues pruned to eliminate duplicates Z: 50 57.308 2.714 0.778 0.698 0.959 0.714 CA 1.477 50 residues pruned to eliminate duplicates Z: 49 72.500 2.743 0.994 0.721 0.958 0.708 CA 1.635 49 residues pruned to eliminate duplicates Z: 30 42.990 2.685 0.732 0.745 0.966 0.724 CA 1.428 30 residues pruned to eliminate duplicates Z: 32 39.322 2.566 0.869 0.631 0.903 0.484 CA 1.442 32 residues pruned to eliminate duplicates Z: 12 30.479 2.304 1.161 0.737 0.909 0.364 CA 1.641 12 residues pruned to eliminate duplicates Z: 30 46.811 2.604 0.928 0.725 0.931 0.586 CA 1.518 30 residues pruned to eliminate duplicates Z: 214 107.414 2.588 0.679 0.550 0.906 0.662 CA 1.781 214 residues pruned to eliminate duplicates Z: 31 46.759 2.641 0.945 0.786 0.867 0.667 CA 1.491 31 residues pruned to eliminate duplicates Z: 23 29.053 2.526 0.691 0.638 0.864 0.545 CB 1.476 23 residues pruned to eliminate duplicates Z: 128 95.285 2.643 0.807 0.601 0.913 0.661 CA 1.760 128 residues pruned to eliminate duplicates Z: 72 78.959 2.751 0.840 0.613 0.930 0.648 CA 1.789 72 residues pruned to eliminate duplicates Z: 155 102.273 2.604 0.789 0.599 0.916 0.688 CA 1.758 104 residues pruned to eliminate duplicates Z: 27 49.163 2.651 0.839 0.823 1.000 0.808 CA 1.495 27 residues pruned to eliminate duplicates Z: 50 70.025 2.744 0.959 0.697 0.959 0.673 CA 1.621 50 residues pruned to eliminate duplicates Z: 30 54.865 2.662 1.269 0.716 0.931 0.690 CA 1.489 30 residues pruned to eliminate duplicates Z: 53 68.323 2.691 0.863 0.663 0.942 0.596 CA 1.725 53 residues pruned to eliminate duplicates Z: 52 68.243 2.606 1.052 0.650 0.922 0.549 CA 1.685 52 residues pruned to eliminate duplicates Z: 126 110.328 2.664 0.962 0.620 0.904 0.664 CA 1.864 126 residues pruned to eliminate duplicates Z: 48 71.469 2.758 0.953 0.735 0.957 0.702 CA 1.636 48 residues pruned to eliminate duplicates Z: 49 81.381 2.731 1.157 0.721 0.958 0.542 CA 1.705 49 residues pruned to eliminate duplicates Z: 49 65.593 2.731 0.812 0.711 0.979 0.688 CA 1.613 49 residues pruned to eliminate duplicates Z: 48 79.787 2.770 1.129 0.722 0.936 0.596 CA 1.724 48 residues pruned to eliminate duplicates Z: 86 85.695 2.640 0.980 0.629 0.871 0.553 CB 1.809 50 residues pruned to eliminate duplicates Z: 24 58.470 2.780 1.061 0.929 0.957 0.522 CA 1.556 24 residues pruned to eliminate duplicates Z: 73 99.189 2.754 1.099 0.640 0.931 0.681 CA 1.906 73 residues pruned to eliminate duplicates Z: 52 85.905 2.736 1.178 0.688 0.922 0.647 CA 1.844 52 residues pruned to eliminate duplicates Z: 49 86.295 2.745 1.161 0.721 0.958 0.625 CA 1.794 49 residues pruned to eliminate duplicates Z: 53 76.682 2.705 1.066 0.667 0.923 0.577 CA 1.766 53 residues pruned to eliminate duplicates Z: 50 85.682 2.755 1.258 0.698 0.918 0.714 CA 1.789 50 residues pruned to eliminate duplicates Z: 119 96.056 2.633 0.884 0.604 0.890 0.593 CA 1.814 119 residues pruned to eliminate duplicates Z: 30 61.724 2.811 1.349 0.733 0.862 0.655 CA 1.634 30 residues pruned to eliminate duplicates Z: 33 59.907 2.779 1.147 0.636 0.938 0.656 CA 1.666 33 residues pruned to eliminate duplicates Z: 130 103.750 2.647 0.842 0.642 0.930 0.736 CA 1.764 130 residues pruned to eliminate duplicates Z: 52 80.694 2.734 1.220 0.678 0.882 0.569 CA 1.791 52 residues pruned to eliminate duplicates Z: 47 70.539 2.685 1.071 0.710 0.913 0.457 CA 1.694 47 residues pruned to eliminate duplicates Z: 136 113.440 2.651 0.949 0.604 0.933 0.719 CA 1.833 136 residues pruned to eliminate duplicates Z: 37 81.245 2.860 1.217 0.722 1.000 0.667 CA 1.747 37 residues pruned to eliminate duplicates Z: 98 79.072 2.554 0.967 0.565 0.876 0.598 CB 1.713 98 residues pruned to eliminate duplicates Z: 128 113.968 2.676 0.974 0.638 0.906 0.669 CA 1.857 128 residues pruned to eliminate duplicates Z: 75 82.041 2.650 1.128 0.615 0.865 0.541 CA 1.754 75 residues pruned to eliminate duplicates Z: 66 89.976 2.730 1.240 0.620 0.892 0.662 CB 1.827 66 residues pruned to eliminate duplicates Z: 50 70.911 2.662 1.221 0.633 0.898 0.531 CA 1.685 50 residues pruned to eliminate duplicates Z: 47 93.159 2.812 1.360 0.752 0.935 0.609 CA 1.769 47 residues pruned to eliminate duplicates Z: 75 97.362 2.743 1.156 0.642 0.932 0.581 CA 1.797 75 residues pruned to eliminate duplicates Z: 233 133.992 2.635 0.818 0.575 0.935 0.655 CB 1.826 233 residues pruned to eliminate duplicates Z: 64 82.305 2.713 1.105 0.592 0.905 0.698 CA 1.839 64 residues pruned to eliminate duplicates Z: 117 99.743 2.665 0.897 0.612 0.879 0.647 CA 1.873 117 residues pruned to eliminate duplicates Z: 86 79.805 2.593 0.822 0.611 0.918 0.635 CA 1.798 86 residues pruned to eliminate duplicates Z: 30 46.388 2.663 0.968 0.466 0.897 0.517 CA 1.897 30 residues pruned to eliminate duplicates Z: 85 79.724 2.597 0.851 0.597 0.905 0.726 CA 1.823 85 residues pruned to eliminate duplicates Z: 189 114.857 2.622 0.807 0.549 0.910 0.633 CB 1.853 53 residues pruned to eliminate duplicates Z: 11 33.085 2.471 1.306 0.696 1.000 0.800 CA 1.535 11 residues pruned to eliminate duplicates Z: 65 93.198 2.792 1.156 0.621 0.938 0.500 CA 1.841 56 residues pruned to eliminate duplicates Z: 11 25.068 2.434 0.758 0.676 0.900 0.600 CA 1.751 11 residues pruned to eliminate duplicates Z: 205 109.740 2.540 0.746 0.543 0.926 0.647 CA 1.792 205 residues pruned to eliminate duplicates Z: 136 105.047 2.661 0.903 0.619 0.904 0.644 CA 1.766 136 residues pruned to eliminate duplicates Z: 81 70.264 2.612 0.708 0.568 0.913 0.675 CA 1.806 81 residues pruned to eliminate duplicates Z: 159 96.270 2.579 0.704 0.529 0.918 0.646 CA 1.845 159 residues pruned to eliminate duplicates Z: 73 97.034 2.776 1.102 0.620 0.931 0.514 CA 1.880 63 residues pruned to eliminate duplicates Z: 12 25.530 2.366 0.870 0.663 0.909 0.545 CA 1.646 12 residues pruned to eliminate duplicates Z: 31 45.822 2.592 1.089 0.445 0.900 0.500 CA 1.816 31 residues pruned to eliminate duplicates Z: 29 44.997 2.631 0.986 0.487 0.893 0.571 CA 1.847 29 residues pruned to eliminate duplicates Z: 29 47.873 2.743 1.135 0.463 0.857 0.429 CA 1.871 29 residues pruned to eliminate duplicates Z: 83 92.014 2.717 1.078 0.607 0.890 0.573 CA 1.826 83 residues pruned to eliminate duplicates Z: 42 49.165 2.594 0.852 0.470 0.854 0.610 CB 1.930 42 residues pruned to eliminate duplicates Z: 88 70.474 2.562 0.701 0.574 0.897 0.621 CA 1.801 88 residues pruned to eliminate duplicates Z: 29 49.248 2.664 1.086 0.481 0.893 0.500 CA 1.912 29 residues pruned to eliminate duplicates Z: 76 92.119 2.764 1.093 0.625 0.933 0.640 CA 1.750 76 residues pruned to eliminate duplicates Z: 166 91.146 2.550 0.713 0.504 0.891 0.630 CB 1.816 166 residues pruned to eliminate duplicates Z: 193 118.651 2.615 0.876 0.566 0.906 0.604 CB 1.807 193 residues pruned to eliminate duplicates Z: 75 85.985 2.739 1.053 0.592 0.905 0.500 CA 1.797 75 residues pruned to eliminate duplicates Z: 134 87.292 2.598 0.684 0.512 0.910 0.654 CA 1.880 134 residues pruned to eliminate duplicates Z: 114 96.349 2.648 0.867 0.603 0.929 0.602 CA 1.789 114 residues pruned to eliminate duplicates Z: 208 116.677 2.610 0.799 0.556 0.913 0.604 CB 1.791 208 residues pruned to eliminate duplicates Z: 190 119.237 2.630 0.818 0.560 0.926 0.693 CA 1.849 190 residues pruned to eliminate duplicates Z: 142 102.506 2.617 0.839 0.610 0.894 0.610 CA 1.809 142 residues pruned to eliminate duplicates Z: 49 54.499 2.569 0.604 0.622 0.938 0.792 CA 1.816 49 residues pruned to eliminate duplicates Z: 201 118.078 2.630 0.729 0.576 0.930 0.680 CA 1.835 201 residues pruned to eliminate duplicates Z: 221 109.415 2.581 0.757 0.525 0.882 0.655 CB 1.800 221 residues pruned to eliminate duplicates Z: 60 53.340 2.480 0.524 0.662 0.915 0.763 CA 1.728 60 residues pruned to eliminate duplicates Z: 152 87.167 2.552 0.668 0.527 0.921 0.642 CB 1.762 152 residues pruned to eliminate duplicates Z: 121 101.214 2.639 0.895 0.631 0.942 0.708 CA 1.735 121 residues pruned to eliminate duplicates Z: 213 118.452 2.599 0.801 0.548 0.915 0.608 CA 1.813 213 residues pruned to eliminate duplicates Z: 86 69.366 2.555 0.770 0.585 0.859 0.671 CB 1.784 86 residues pruned to eliminate duplicates Z: 208 115.010 2.616 0.775 0.560 0.908 0.618 CB 1.789 208 residues pruned to eliminate duplicates Z: 134 109.605 2.649 0.973 0.614 0.910 0.609 CA 1.795 134 residues pruned to eliminate duplicates Z: 58 48.799 2.465 0.521 0.635 0.877 0.649 CA 1.732 58 residues pruned to eliminate duplicates Z: 136 78.712 2.551 0.539 0.528 0.933 0.600 CB 1.798 136 residues pruned to eliminate duplicates Z: 133 108.672 2.667 0.929 0.628 0.917 0.644 CA 1.779 133 residues pruned to eliminate duplicates Z: 86 66.964 2.584 0.648 0.585 0.894 0.694 CA 1.758 86 residues pruned to eliminate duplicates Z: 76 72.189 2.590 0.777 0.590 0.920 0.640 CA 1.805 76 residues pruned to eliminate duplicates Z: 226 124.781 2.616 0.840 0.548 0.907 0.600 CB 1.818 226 residues pruned to eliminate duplicates Z: 53 51.468 2.530 0.633 0.601 0.885 0.712 CA 1.772 53 residues pruned to eliminate duplicates Z: 149 110.965 2.643 0.921 0.591 0.912 0.662 CA 1.805 149 residues pruned to eliminate duplicates Z: 162 91.535 2.576 0.685 0.520 0.919 0.627 CB 1.773 162 residues pruned to eliminate duplicates Z: 216 119.237 2.584 0.792 0.561 0.926 0.633 CA 1.788 216 residues pruned to eliminate duplicates Z: 187 108.917 2.584 0.780 0.561 0.903 0.613 CB 1.812 187 residues pruned to eliminate duplicates Z: 123 108.768 2.659 0.987 0.607 0.926 0.582 CA 1.818 123 residues pruned to eliminate duplicates Z: 76 66.380 2.549 0.621 0.593 0.947 0.747 CA 1.793 76 residues pruned to eliminate duplicates Z: 60 62.861 2.557 0.721 0.642 0.932 0.729 CB 1.747 60 residues pruned to eliminate duplicates Z: 109 99.731 2.702 0.828 0.624 0.935 0.639 CA 1.848 109 residues pruned to eliminate duplicates Z: 139 80.660 2.554 0.582 0.526 0.920 0.674 CB 1.799 139 residues pruned to eliminate duplicates Z: 217 117.834 2.615 0.758 0.552 0.921 0.620 CB 1.799 217 residues pruned to eliminate duplicates Z: 113 95.806 2.634 0.930 0.609 0.911 0.607 CA 1.764 113 residues pruned to eliminate duplicates Z: 184 106.012 2.615 0.712 0.557 0.907 0.634 CA 1.825 184 residues pruned to eliminate duplicates Z: 122 95.191 2.646 0.805 0.598 0.926 0.603 CA 1.783 122 residues pruned to eliminate duplicates Z: 129 103.236 2.666 0.864 0.630 0.938 0.664 CA 1.734 129 residues pruned to eliminate duplicates Z: 83 63.321 2.567 0.685 0.562 0.866 0.695 CA 1.758 83 residues pruned to eliminate duplicates Z: 132 72.473 2.545 0.597 0.487 0.885 0.664 CB 1.781 132 residues pruned to eliminate duplicates Z: 111 100.361 2.678 0.814 0.638 0.964 0.627 CA 1.797 111 residues pruned to eliminate duplicates Z: 54 60.385 2.517 0.690 0.683 0.925 0.736 CA 1.784 54 residues pruned to eliminate duplicates Z: 80 68.341 2.559 0.638 0.592 0.962 0.684 CA 1.747 80 residues pruned to eliminate duplicates Z: 31 28.952 2.383 0.527 0.510 0.867 0.733 CB 1.660 31 residues pruned to eliminate duplicates Z: 85 72.216 2.577 0.755 0.584 0.905 0.643 CB 1.777 85 residues pruned to eliminate duplicates Z: 53 56.397 2.511 0.587 0.666 0.942 0.712 CA 1.786 53 residues pruned to eliminate duplicates Z: 129 99.488 2.672 0.842 0.625 0.891 0.672 CA 1.782 129 residues pruned to eliminate duplicates Z: 165 97.319 2.568 0.721 0.519 0.945 0.659 CB 1.785 165 residues pruned to eliminate duplicates Z: 163 90.359 2.576 0.723 0.513 0.877 0.673 CB 1.801 163 residues pruned to eliminate duplicates Z: 68 54.396 2.509 0.665 0.568 0.896 0.612 CA 1.663 68 residues pruned to eliminate duplicates Z: 109 97.229 2.658 0.965 0.617 0.898 0.611 CA 1.785 109 residues pruned to eliminate duplicates Z: 137 85.318 2.558 0.684 0.528 0.912 0.662 CB 1.812 137 residues pruned to eliminate duplicates Z: 131 105.785 2.629 0.956 0.594 0.908 0.569 CA 1.816 131 residues pruned to eliminate duplicates Z: 230 127.457 2.615 0.824 0.553 0.921 0.638 CB 1.820 230 residues pruned to eliminate duplicates Z: 87 75.156 2.620 0.834 0.568 0.895 0.581 CA 1.763 87 residues pruned to eliminate duplicates Z: 130 113.653 2.669 0.986 0.632 0.930 0.636 CA 1.793 130 residues pruned to eliminate duplicates Z: 203 117.460 2.582 0.868 0.553 0.896 0.629 CB 1.816 203 residues pruned to eliminate duplicates Z: 194 120.866 2.629 0.860 0.554 0.917 0.611 CA 1.840 194 residues pruned to eliminate duplicates Z: 217 118.316 2.626 0.768 0.534 0.921 0.620 CA 1.819 217 residues pruned to eliminate duplicates Z: 163 94.122 2.574 0.689 0.523 0.920 0.642 CB 1.807 163 residues pruned to eliminate duplicates Z: 137 83.071 2.532 0.647 0.544 0.919 0.676 CB 1.780 137 residues pruned to eliminate duplicates Z: 153 118.516 2.655 0.962 0.600 0.921 0.559 CA 1.822 153 residues pruned to eliminate duplicates Z: 6 5.293 1.770 0.305 0.408 1.000 0.800 CA 1.129 6 residues pruned to eliminate duplicates Z: 183 113.481 2.617 0.849 0.564 0.907 0.621 CB 1.802 183 residues pruned to eliminate duplicates Z: 79 52.710 2.513 0.596 0.436 0.885 0.615 CB 1.797 79 residues pruned to eliminate duplicates Z: 75 51.080 2.504 0.582 0.454 0.905 0.622 CB 1.735 75 residues pruned to eliminate duplicates Z: 99 68.489 2.553 0.635 0.481 0.959 0.653 CB 1.761 99 residues pruned to eliminate duplicates Z: 47 42.716 2.584 0.614 0.399 0.935 0.652 CB 1.798 47 residues pruned to eliminate duplicates Z: 202 127.036 2.614 0.914 0.590 0.915 0.607 CB 1.796 202 residues pruned to eliminate duplicates Z: 123 85.221 2.529 0.744 0.553 0.951 0.623 CB 1.747 123 residues pruned to eliminate duplicates Z: 49 43.075 2.538 0.614 0.397 0.938 0.667 CB 1.806 49 residues pruned to eliminate duplicates Z: 80 56.226 2.535 0.642 0.420 0.924 0.570 CB 1.787 80 residues pruned to eliminate duplicates Z: 118 71.687 2.491 0.675 0.475 0.949 0.615 CB 1.718 118 residues pruned to eliminate duplicates Z: 98 56.254 2.529 0.496 0.435 0.928 0.639 CB 1.739 98 residues pruned to eliminate duplicates Z: 231 129.075 2.626 0.817 0.564 0.930 0.613 CB 1.801 231 residues pruned to eliminate duplicates Z: 205 113.722 2.592 0.833 0.528 0.902 0.583 CB 1.808 205 residues pruned to eliminate duplicates Z: 76 53.219 2.564 0.549 0.437 0.933 0.627 CB 1.769 76 residues pruned to eliminate duplicates Z: 96 66.288 2.570 0.609 0.470 0.947 0.642 CB 1.790 96 residues pruned to eliminate duplicates Z: 58 45.455 2.447 0.610 0.463 0.877 0.596 CB 1.809 58 residues pruned to eliminate duplicates Z: 170 89.693 2.546 0.658 0.490 0.923 0.586 CB 1.788 170 residues pruned to eliminate duplicates Z: 164 96.084 2.572 0.764 0.513 0.908 0.644 CB 1.804 164 residues pruned to eliminate duplicates Z: 83 52.343 2.508 0.605 0.404 0.890 0.585 CB 1.784 83 residues pruned to eliminate duplicates Z: 155 70.520 2.511 0.558 0.435 0.896 0.571 CB 1.734 155 residues pruned to eliminate duplicates Z: 78 57.065 2.540 0.579 0.459 0.922 0.636 CB 1.834 78 residues pruned to eliminate duplicates Z: 212 109.874 2.577 0.799 0.524 0.896 0.555 CB 1.780 212 residues pruned to eliminate duplicates Z: 76 51.126 2.526 0.510 0.434 0.947 0.613 CB 1.750 76 residues pruned to eliminate duplicates Z: 66 55.305 2.547 0.557 0.481 0.938 0.677 CB 1.879 66 residues pruned to eliminate duplicates Z: 203 116.535 2.611 0.825 0.524 0.916 0.629 CA 1.835 203 residues pruned to eliminate duplicates Z: 64 53.667 2.552 0.557 0.475 0.952 0.714 CB 1.833 64 residues pruned to eliminate duplicates Z: 51 55.864 2.615 0.699 0.504 0.940 0.720 CB 1.884 51 residues pruned to eliminate duplicates Z: 77 52.309 2.523 0.561 0.437 0.921 0.579 CB 1.765 77 residues pruned to eliminate duplicates Z: 80 49.358 2.519 0.532 0.397 0.924 0.570 CB 1.736 80 residues pruned to eliminate duplicates Z: 74 52.660 2.518 0.580 0.459 0.904 0.630 CB 1.786 74 residues pruned to eliminate duplicates Z: 165 100.529 2.582 0.801 0.504 0.915 0.640 CB 1.839 165 residues pruned to eliminate duplicates Z: 66 48.551 2.549 0.538 0.454 0.923 0.600 CB 1.744 66 residues pruned to eliminate duplicates Z: 106 50.253 2.428 0.612 0.380 0.886 0.533 CB 1.607 106 residues pruned to eliminate duplicates Z: 81 53.598 2.448 0.577 0.458 0.913 0.613 CB 1.775 81 residues pruned to eliminate duplicates Z: 54 51.481 2.571 0.625 0.478 0.962 0.623 CB 1.800 54 residues pruned to eliminate duplicates Z: 73 50.016 2.479 0.567 0.460 0.931 0.528 CB 1.698 73 residues pruned to eliminate duplicates Z: 201 100.351 2.590 0.719 0.498 0.870 0.565 CB 1.835 201 residues pruned to eliminate duplicates Z: 39 43.551 2.463 0.676 0.548 0.974 0.711 CB 1.678 39 residues pruned to eliminate duplicates Z: 54 52.521 2.570 0.697 0.479 0.925 0.660 CB 1.827 54 residues pruned to eliminate duplicates Z: 52 55.231 2.583 0.678 0.477 0.941 0.588 CB 1.940 52 residues pruned to eliminate duplicates Z: 203 118.334 2.604 0.860 0.554 0.896 0.564 CB 1.820 203 residues pruned to eliminate duplicates Z: 51 57.302 2.604 0.727 0.516 0.940 0.720 CB 1.887 51 residues pruned to eliminate duplicates Z: 81 51.481 2.512 0.554 0.426 0.900 0.637 CB 1.770 81 residues pruned to eliminate duplicates Z: 50 52.515 2.578 0.769 0.493 0.898 0.633 CB 1.845 50 residues pruned to eliminate duplicates Z: 79 54.400 2.536 0.573 0.441 0.923 0.590 CB 1.777 79 residues pruned to eliminate duplicates Z: 167 86.443 2.552 0.689 0.504 0.898 0.620 CB 1.727 167 residues pruned to eliminate duplicates Z: 57 50.651 2.492 0.706 0.461 0.929 0.554 CB 1.785 57 residues pruned to eliminate duplicates Z: 55 52.913 2.548 0.688 0.471 0.926 0.630 CB 1.864 55 residues pruned to eliminate duplicates Z: 102 59.933 2.533 0.572 0.448 0.921 0.594 CB 1.716 102 residues pruned to eliminate duplicates Z: 29 38.890 2.497 0.555 0.646 0.893 0.571 CB 1.850 29 residues pruned to eliminate duplicates Z: 76 53.909 2.566 0.557 0.433 0.920 0.627 CB 1.816 76 residues pruned to eliminate duplicates Z: 58 49.391 2.478 0.669 0.461 0.930 0.596 CB 1.771 58 residues pruned to eliminate duplicates Z: 70 57.699 2.549 0.656 0.484 0.928 0.609 CB 1.803 70 residues pruned to eliminate duplicates Z: 73 54.004 2.510 0.617 0.467 0.931 0.625 CB 1.742 73 residues pruned to eliminate duplicates Z: 51 57.900 2.605 0.767 0.490 0.960 0.620 CB 1.871 51 residues pruned to eliminate duplicates Z: 53 51.184 2.577 0.651 0.498 0.923 0.692 CB 1.811 53 residues pruned to eliminate duplicates Z: 97 65.811 2.543 0.602 0.454 0.958 0.583 CB 1.804 97 residues pruned to eliminate duplicates Z: 46 49.678 2.580 0.712 0.509 0.911 0.667 CB 1.823 46 residues pruned to eliminate duplicates Z: 181 89.548 2.561 0.627 0.493 0.911 0.572 CB 1.770 181 residues pruned to eliminate duplicates Z: 25 24.005 2.398 0.755 0.427 0.792 0.583 CA 1.587 25 residues pruned to eliminate duplicates Z: 206 119.115 2.630 0.808 0.539 0.922 0.649 CA 1.827 206 residues pruned to eliminate duplicates Z: 81 53.265 2.496 0.616 0.422 0.950 0.663 CB 1.686 81 residues pruned to eliminate duplicates Z: 100 70.125 2.541 0.773 0.468 0.929 0.657 CB 1.739 100 residues pruned to eliminate duplicates Z: 25 28.480 2.583 0.664 0.370 0.917 0.500 CB 1.697 25 residues pruned to eliminate duplicates Z: 71 52.554 2.498 0.716 0.461 0.900 0.543 CB 1.693 71 residues pruned to eliminate duplicates Z: 76 56.943 2.589 0.653 0.426 0.933 0.640 CB 1.778 76 residues pruned to eliminate duplicates Z: 96 71.720 2.514 0.669 0.536 0.947 0.642 CA 1.786 96 residues pruned to eliminate duplicates Z: 77 62.512 2.538 0.817 0.488 0.921 0.566 CB 1.708 77 residues pruned to eliminate duplicates Z: 80 52.166 2.509 0.635 0.396 0.949 0.608 CB 1.683 80 residues pruned to eliminate duplicates Z: 59 51.387 2.529 0.736 0.459 0.897 0.672 CB 1.788 59 residues pruned to eliminate duplicates Z: 86 50.305 2.474 0.683 0.410 0.882 0.565 CB 1.631 86 residues pruned to eliminate duplicates Z: 76 58.563 2.534 0.686 0.495 0.907 0.613 CA 1.755 76 residues pruned to eliminate duplicates Z: 54 49.612 2.487 0.708 0.520 0.887 0.566 CB 1.774 54 residues pruned to eliminate duplicates Z: 26 25.547 2.405 0.884 0.362 0.760 0.440 CA 1.722 26 residues pruned to eliminate duplicates Z: 94 65.351 2.569 0.653 0.489 0.860 0.581 CB 1.875 94 residues pruned to eliminate duplicates Z: 120 67.634 2.501 0.616 0.465 0.891 0.613 CB 1.784 120 residues pruned to eliminate duplicates Z: 255 131.443 2.607 0.870 0.532 0.894 0.571 CA 1.834 255 residues pruned to eliminate duplicates Z: 54 52.780 2.535 0.742 0.534 0.906 0.623 CB 1.753 54 residues pruned to eliminate duplicates Z: 44 48.397 2.526 0.601 0.571 0.953 0.698 CA 1.787 44 residues pruned to eliminate duplicates Z: 50 51.709 2.575 0.696 0.580 0.898 0.571 CB 1.744 50 residues pruned to eliminate duplicates Z: 48 54.821 2.570 0.751 0.594 0.894 0.638 CA 1.818 48 residues pruned to eliminate duplicates Z: 53 50.967 2.561 0.641 0.527 0.904 0.596 CA 1.812 53 residues pruned to eliminate duplicates Z: 41 47.670 2.601 0.533 0.586 0.950 0.650 CA 1.833 41 residues pruned to eliminate duplicates Z: 51 55.423 2.562 0.643 0.560 0.960 0.640 CB 1.830 51 residues pruned to eliminate duplicates Z: 20 30.864 2.640 0.603 0.446 0.895 0.684 CA 1.976 20 residues pruned to eliminate duplicates Z: 38 36.691 2.342 0.636 0.533 0.838 0.676 CA 1.819 38 residues pruned to eliminate duplicates Z: 43 43.352 2.500 0.648 0.537 0.905 0.643 CB 1.730 43 residues pruned to eliminate duplicates Z: 50 58.913 2.549 0.759 0.592 0.959 0.714 CB 1.791 50 residues pruned to eliminate duplicates Z: 34 48.366 2.598 0.732 0.588 0.939 0.758 CA 1.831 34 residues pruned to eliminate duplicates Z: 33 33.998 2.474 0.542 0.532 0.844 0.688 CB 1.810 33 residues pruned to eliminate duplicates Z: 51 53.823 2.504 0.729 0.556 0.880 0.680 CB 1.892 51 residues pruned to eliminate duplicates Z: 51 52.108 2.546 0.707 0.566 0.920 0.640 CA 1.730 51 residues pruned to eliminate duplicates Z: 53 58.877 2.503 0.789 0.590 0.942 0.692 CB 1.776 53 residues pruned to eliminate duplicates Z: 41 50.192 2.627 0.571 0.611 0.900 0.700 CB 1.924 41 residues pruned to eliminate duplicates Z: 50 52.891 2.541 0.690 0.569 0.918 0.653 CB 1.792 50 residues pruned to eliminate duplicates Z: 23 39.467 2.576 0.665 0.671 0.864 0.682 CA 1.940 23 residues pruned to eliminate duplicates Z: 21 35.265 2.626 0.448 0.713 0.900 0.800 CA 1.901 21 residues pruned to eliminate duplicates Z: 30 32.658 2.422 0.610 0.548 0.828 0.586 CA 1.793 30 residues pruned to eliminate duplicates Z: 40 46.052 2.589 0.679 0.547 0.897 0.718 CA 1.806 40 residues pruned to eliminate duplicates Z: 32 35.356 2.526 0.512 0.681 0.871 0.645 CB 1.616 32 residues pruned to eliminate duplicates Z: 32 46.292 2.621 0.696 0.645 0.903 0.774 CB 1.809 32 residues pruned to eliminate duplicates Z: 34 35.413 2.545 0.517 0.528 0.879 0.697 CA 1.767 34 residues pruned to eliminate duplicates Z: 50 50.150 2.566 0.666 0.572 0.918 0.694 CB 1.702 50 residues pruned to eliminate duplicates Z: 31 40.465 2.556 0.637 0.642 0.933 0.733 CB 1.655 31 residues pruned to eliminate duplicates Z: 142 82.035 2.557 0.652 0.506 0.915 0.603 CB 1.776 142 residues pruned to eliminate duplicates Z: 22 43.340 2.569 0.782 0.710 0.905 0.714 CA 1.887 22 residues pruned to eliminate duplicates Z: 50 45.337 2.483 0.616 0.536 0.878 0.673 CA 1.776 50 residues pruned to eliminate duplicates Z: 32 40.086 2.574 0.639 0.639 0.871 0.774 CB 1.720 32 residues pruned to eliminate duplicates Z: 33 53.964 2.620 0.908 0.599 0.938 0.688 CA 1.852 33 residues pruned to eliminate duplicates Z: 45 48.285 2.546 0.724 0.540 0.886 0.591 CA 1.798 45 residues pruned to eliminate duplicates Z: 24 36.659 2.483 0.654 0.658 0.870 0.783 CA 1.847 24 residues pruned to eliminate duplicates Z: 45 46.134 2.413 0.865 0.527 0.864 0.591 CB 1.741 45 residues pruned to eliminate duplicates Z: 67 53.435 2.379 0.789 0.593 0.909 0.697 CB 1.555 67 residues pruned to eliminate duplicates Z: 43 55.940 2.607 0.820 0.608 0.905 0.643 CB 1.815 43 residues pruned to eliminate duplicates Z: 50 57.902 2.610 0.811 0.559 0.878 0.633 CA 1.883 50 residues pruned to eliminate duplicates Z: 11 15.553 2.580 0.438 0.605 0.900 0.600 CB 1.333 11 residues pruned to eliminate duplicates Z: 17 26.689 2.629 0.589 0.597 0.875 0.688 CB 1.663 17 residues pruned to eliminate duplicates Z: 51 54.626 2.603 0.729 0.567 0.880 0.720 CB 1.827 51 residues pruned to eliminate duplicates Z: 33 38.327 2.591 0.447 0.648 0.906 0.750 CB 1.738 33 residues pruned to eliminate duplicates Z: 55 47.103 2.584 0.603 0.551 0.852 0.704 CB 1.729 55 residues pruned to eliminate duplicates Z: 11 18.508 2.512 0.566 0.595 1.000 0.800 CB 1.358 11 residues pruned to eliminate duplicates Z: 10 17.534 2.646 0.455 0.671 1.000 0.778 CB 1.296 10 residues pruned to eliminate duplicates Z: 52 55.586 2.588 0.828 0.541 0.902 0.588 CB 1.752 52 residues pruned to eliminate duplicates Z: 73 47.042 2.313 0.671 0.552 0.903 0.597 CB 1.510 73 residues pruned to eliminate duplicates Z: 33 29.230 2.428 0.517 0.583 0.938 0.688 CB 1.382 33 residues pruned to eliminate duplicates Z: 66 46.574 2.366 0.642 0.593 0.908 0.662 CB 1.500 66 residues pruned to eliminate duplicates Z: 23 25.478 2.258 0.612 0.702 0.909 0.727 CB 1.367 23 residues pruned to eliminate duplicates Z: 31 20.025 2.146 0.646 0.539 0.833 0.467 CB 1.196 31 residues pruned to eliminate duplicates Z: 20 11.108 2.096 0.701 0.279 0.737 0.263 CB 1.245 20 residues pruned to eliminate duplicates Z: 31 25.605 2.157 0.879 0.548 0.867 0.500 CB 1.270 31 residues pruned to eliminate duplicates Z: 20 15.229 2.034 0.665 0.407 0.789 0.421 CB 1.440 20 residues pruned to eliminate duplicates Z: 26 27.862 2.221 0.694 0.695 0.880 0.640 CB 1.408 26 residues pruned to eliminate duplicates Z: 23 29.680 2.346 0.752 0.695 0.909 0.545 CB 1.417 23 residues pruned to eliminate duplicates Z: 33 33.685 2.445 0.821 0.628 0.906 0.562 CB 1.309 33 residues pruned to eliminate duplicates Z: 33 26.103 2.178 0.825 0.538 0.906 0.375 CB 1.235 33 residues pruned to eliminate duplicates Z: 22 34.614 2.362 0.957 0.692 0.905 0.524 CB 1.515 22 residues pruned to eliminate duplicates Z: 27 34.553 2.263 0.961 0.679 0.923 0.577 CB 1.403 27 residues pruned to eliminate duplicates Z: 76 49.641 2.428 0.782 0.583 0.907 0.533 CB 1.348 76 residues pruned to eliminate duplicates Z: 34 28.998 2.356 0.868 0.572 0.879 0.364 CB 1.217 34 residues pruned to eliminate duplicates Z: 55 47.498 2.457 0.540 0.663 0.944 0.574 CB 1.555 55 residues pruned to eliminate duplicates Z: 23 36.295 2.347 1.144 0.719 0.955 0.545 CB 1.321 23 residues pruned to eliminate duplicates Z: 77 58.141 2.511 0.689 0.553 0.908 0.487 CB 1.645 77 residues pruned to eliminate duplicates Z: 54 48.332 2.497 0.687 0.629 0.887 0.660 CB 1.575 54 residues pruned to eliminate duplicates Z: 36 27.364 2.285 0.833 0.554 0.829 0.457 CB 1.265 36 residues pruned to eliminate duplicates Z: 60 45.010 2.415 0.726 0.562 0.881 0.441 CB 1.501 60 residues pruned to eliminate duplicates Z: 129 72.199 2.575 0.691 0.462 0.883 0.633 CB 1.726 129 residues pruned to eliminate duplicates Z: 61 42.539 2.389 0.790 0.488 0.883 0.433 CB 1.471 61 residues pruned to eliminate duplicates Z: 119 68.734 2.576 0.527 0.492 0.924 0.661 CB 1.756 119 residues pruned to eliminate duplicates Z: 26 32.070 2.473 0.692 0.428 0.960 0.600 CB 1.720 26 residues pruned to eliminate duplicates Z: 121 84.871 2.677 0.665 0.515 0.925 0.658 CB 1.852 121 residues pruned to eliminate duplicates Z: 56 48.911 2.483 0.678 0.465 0.982 0.673 CB 1.671 56 residues pruned to eliminate duplicates Z: 148 77.910 2.544 0.655 0.508 0.939 0.639 CB 1.613 148 residues pruned to eliminate duplicates Z: 26 26.199 2.460 0.643 0.424 0.920 0.640 CB 1.524 26 residues pruned to eliminate duplicates Z: 60 46.499 2.503 0.723 0.442 0.898 0.610 CB 1.659 60 residues pruned to eliminate duplicates Z: 175 97.850 2.565 0.753 0.523 0.931 0.644 CB 1.732 175 residues pruned to eliminate duplicates Z: 121 78.679 2.610 0.627 0.530 0.908 0.625 CB 1.809 121 residues pruned to eliminate duplicates Z: 61 39.396 2.376 0.709 0.465 0.883 0.483 CB 1.469 61 residues pruned to eliminate duplicates Z: 129 76.403 2.598 0.549 0.505 0.930 0.664 CB 1.796 129 residues pruned to eliminate duplicates Z: 120 71.013 2.571 0.555 0.485 0.916 0.639 CB 1.805 120 residues pruned to eliminate duplicates Z: 115 73.811 2.599 0.648 0.495 0.930 0.623 CB 1.745 115 residues pruned to eliminate duplicates Z: 88 61.840 2.605 0.618 0.478 0.908 0.598 CB 1.771 88 residues pruned to eliminate duplicates Z: 81 56.584 2.432 0.722 0.536 0.900 0.550 CB 1.620 81 residues pruned to eliminate duplicates Z: 49 35.569 2.353 0.746 0.469 0.833 0.500 CB 1.547 49 residues pruned to eliminate duplicates Z: 61 43.150 2.414 0.810 0.493 0.867 0.500 CB 1.482 61 residues pruned to eliminate duplicates Z: 61 36.791 2.343 0.817 0.461 0.867 0.467 CB 1.339 61 residues pruned to eliminate duplicates Z: 116 76.551 2.609 0.625 0.494 0.930 0.591 CB 1.821 116 residues pruned to eliminate duplicates Z: 95 62.215 2.584 0.616 0.445 0.957 0.574 CB 1.699 95 residues pruned to eliminate duplicates Z: 61 37.653 2.395 0.730 0.478 0.900 0.417 CB 1.333 61 residues pruned to eliminate duplicates Z: 27 24.391 2.422 0.576 0.339 0.923 0.500 CB 1.619 27 residues pruned to eliminate duplicates Z: 103 61.954 2.621 0.562 0.468 0.912 0.657 CB 1.698 103 residues pruned to eliminate duplicates Z: 89 60.743 2.603 0.555 0.472 0.932 0.636 CB 1.765 89 residues pruned to eliminate duplicates Z: 127 84.020 2.623 0.663 0.502 0.937 0.635 CB 1.828 127 residues pruned to eliminate duplicates Z: 114 74.479 2.624 0.599 0.499 0.929 0.619 CB 1.800 114 residues pruned to eliminate duplicates Z: 111 68.939 2.574 0.593 0.506 0.891 0.627 CB 1.788 111 residues pruned to eliminate duplicates Z: 84 57.100 2.552 0.703 0.465 0.892 0.518 CB 1.678 84 residues pruned to eliminate duplicates Z: 156 87.418 2.573 0.700 0.514 0.910 0.606 CB 1.741 156 residues pruned to eliminate duplicates Z: 93 57.430 2.590 0.545 0.437 0.924 0.609 CB 1.727 93 residues pruned to eliminate duplicates Z: 97 80.177 2.688 0.671 0.532 0.938 0.635 CB 1.883 97 residues pruned to eliminate duplicates Z: 117 79.351 2.629 0.655 0.499 0.922 0.664 CB 1.837 117 residues pruned to eliminate duplicates Z: 79 53.089 2.464 0.756 0.465 0.897 0.487 CB 1.604 79 residues pruned to eliminate duplicates Z: 89 70.947 2.675 0.560 0.545 0.909 0.682 CB 1.908 89 residues pruned to eliminate duplicates Z: 94 77.189 2.697 0.550 0.551 0.935 0.634 CB 1.947 94 residues pruned to eliminate duplicates Z: 28 38.987 2.607 0.713 0.501 0.926 0.667 CB 1.813 28 residues pruned to eliminate duplicates Z: 93 66.058 2.641 0.582 0.519 0.870 0.641 CB 1.860 93 residues pruned to eliminate duplicates Z: 92 58.030 2.595 0.536 0.458 0.934 0.582 CB 1.706 92 residues pruned to eliminate duplicates Z: 90 75.228 2.671 0.578 0.551 0.955 0.640 CB 1.886 90 residues pruned to eliminate duplicates Z: 121 82.692 2.650 0.636 0.502 0.933 0.633 CB 1.863 121 residues pruned to eliminate duplicates Z: 68 56.254 2.612 0.597 0.494 0.940 0.597 CB 1.763 68 residues pruned to eliminate duplicates Z: 68 50.469 2.604 0.540 0.461 0.896 0.582 CB 1.786 68 residues pruned to eliminate duplicates Z: 75 60.568 2.702 0.610 0.502 0.905 0.649 CB 1.784 75 residues pruned to eliminate duplicates Z: 61 60.834 2.697 0.577 0.522 0.967 0.700 CB 1.869 61 residues pruned to eliminate duplicates Z: 69 51.920 2.617 0.500 0.488 0.912 0.588 CB 1.781 69 residues pruned to eliminate duplicates Z: 43 43.413 2.578 0.540 0.508 0.929 0.643 CB 1.803 43 residues pruned to eliminate duplicates Z: 130 74.893 2.578 0.585 0.484 0.907 0.612 CB 1.808 130 residues pruned to eliminate duplicates Z: 77 71.933 2.707 0.567 0.589 0.934 0.632 CB 1.911 77 residues pruned to eliminate duplicates Z: 183 92.858 2.573 0.616 0.523 0.912 0.648 CB 1.774 183 residues pruned to eliminate duplicates Z: 74 76.494 2.729 0.694 0.584 0.904 0.685 CB 1.976 74 residues pruned to eliminate duplicates Z: 87 66.901 2.632 0.625 0.520 0.884 0.663 CB 1.871 87 residues pruned to eliminate duplicates Z: 114 76.777 2.621 0.628 0.501 0.903 0.628 CB 1.874 114 residues pruned to eliminate duplicates Z: 70 72.004 2.713 0.589 0.581 0.928 0.739 CB 2.005 70 residues pruned to eliminate duplicates Z: 98 83.533 2.696 0.651 0.552 0.938 0.629 CB 1.931 98 residues pruned to eliminate duplicates Z: 28 35.683 2.589 0.569 0.529 0.963 0.667 CB 1.707 28 residues pruned to eliminate duplicates Z: 102 56.985 2.485 0.635 0.436 0.891 0.535 CB 1.673 102 residues pruned to eliminate duplicates Z: 95 62.163 2.593 0.607 0.452 0.915 0.606 CB 1.767 95 residues pruned to eliminate duplicates Z: 60 58.149 2.700 0.593 0.521 0.949 0.712 CB 1.817 60 residues pruned to eliminate duplicates Z: 86 78.058 2.669 0.652 0.566 0.941 0.659 CB 1.914 86 residues pruned to eliminate duplicates Z: 74 70.030 2.704 0.561 0.576 0.932 0.712 CB 1.939 74 residues pruned to eliminate duplicates Z: 94 57.742 2.532 0.609 0.453 0.914 0.624 CB 1.687 94 residues pruned to eliminate duplicates Z: 94 78.139 2.686 0.654 0.521 0.935 0.613 CB 1.909 94 residues pruned to eliminate duplicates Z: 96 84.406 2.730 0.636 0.553 0.947 0.695 CB 1.943 96 residues pruned to eliminate duplicates Z: 124 80.753 2.612 0.618 0.518 0.919 0.618 CB 1.842 124 residues pruned to eliminate duplicates Z: 65 50.514 2.606 0.554 0.458 0.938 0.625 CB 1.736 65 residues pruned to eliminate duplicates Z: 81 75.199 2.666 0.610 0.561 0.963 0.675 CB 1.918 81 residues pruned to eliminate duplicates Z: 76 70.429 2.645 0.756 0.499 0.947 0.667 CB 1.851 76 residues pruned to eliminate duplicates Z: 93 53.927 2.547 0.575 0.434 0.891 0.598 CB 1.683 93 residues pruned to eliminate duplicates Z: 71 52.533 2.628 0.575 0.438 0.914 0.543 CB 1.769 71 residues pruned to eliminate duplicates Z: 88 72.416 2.691 0.666 0.532 0.920 0.621 CB 1.825 88 residues pruned to eliminate duplicates Z: 77 83.402 2.737 0.750 0.565 0.934 0.684 CB 2.007 53 residues pruned to eliminate duplicates Z: 8 19.406 2.591 0.390 0.510 1.000 0.429 CA 2.017 8 residues pruned to eliminate duplicates Z: 52 56.319 2.701 0.620 0.552 0.980 0.706 CB 1.748 52 residues pruned to eliminate duplicates Z: 86 70.316 2.646 0.632 0.525 0.906 0.647 CB 1.902 43 residues pruned to eliminate duplicates Z: 7 5.444 1.861 0.617 0.497 0.833 0.500 CA 0.889 7 residues pruned to eliminate duplicates Z: 51 52.185 2.731 0.668 0.482 0.880 0.580 CB 1.875 51 residues pruned to eliminate duplicates Z: 116 79.261 2.637 0.620 0.508 0.930 0.635 CB 1.845 113 residues pruned to eliminate duplicates Z: 9 21.525 2.647 0.505 0.632 1.000 0.250 CA 1.688 Z: 73 60.221 2.627 0.515 0.500 0.931 0.653 CB 1.916 56 residues pruned to eliminate duplicates Z: 8 18.989 2.430 0.840 0.859 0.857 0.429 CA 1.378 8 residues pruned to eliminate duplicates Z: 87 76.670 2.743 0.592 0.531 0.930 0.616 CB 1.973 87 residues pruned to eliminate duplicates Z: 56 61.457 2.727 0.569 0.568 0.945 0.636 CB 1.918 56 residues pruned to eliminate duplicates Z: 22 22.980 2.617 0.312 0.427 0.905 0.476 CB 1.742 6 residues pruned to eliminate duplicates Z: 8 13.483 2.385 0.451 0.535 1.000 0.714 CA 1.424 Z: 8 9.649 2.146 0.528 0.553 0.857 0.857 CA 1.232 9 residues pruned to eliminate duplicates Z: 80 67.337 2.695 0.593 0.549 0.873 0.633 CB 1.927 87 residues pruned to eliminate duplicates Z: 75 62.336 2.707 0.664 0.466 0.905 0.649 CB 1.840 75 residues pruned to eliminate duplicates Z: 86 82.280 2.736 0.643 0.568 0.965 0.647 CB 1.928 86 residues pruned to eliminate duplicates Z: 98 81.156 2.695 0.719 0.522 0.928 0.598 CB 1.876 98 residues pruned to eliminate duplicates Z: 82 68.939 2.652 0.623 0.539 0.901 0.642 CB 1.901 82 residues pruned to eliminate duplicates Z: 129 80.193 2.618 0.712 0.493 0.906 0.625 CB 1.758 129 residues pruned to eliminate duplicates Z: 95 79.672 2.702 0.679 0.537 0.926 0.606 CB 1.888 95 residues pruned to eliminate duplicates Z: 51 64.407 2.766 0.743 0.570 0.880 0.620 CB 2.006 51 residues pruned to eliminate duplicates Z: 76 72.472 2.699 0.712 0.561 0.867 0.680 CB 1.971 76 residues pruned to eliminate duplicates Z: 73 64.601 2.717 0.636 0.484 0.931 0.639 CB 1.871 73 residues pruned to eliminate duplicates Z: 78 71.882 2.689 0.624 0.570 0.909 0.610 CB 1.930 78 residues pruned to eliminate duplicates Z: 77 76.613 2.735 0.609 0.560 0.961 0.684 CB 1.962 77 residues pruned to eliminate duplicates Z: 109 82.790 2.690 0.687 0.529 0.926 0.602 CB 1.843 109 residues pruned to eliminate duplicates Z: 21 44.036 2.787 0.705 0.600 0.950 0.650 CA 1.983 21 residues pruned to eliminate duplicates Z: 123 83.980 2.661 0.724 0.496 0.893 0.639 CB 1.862 123 residues pruned to eliminate duplicates Z: 106 81.288 2.640 0.676 0.497 0.952 0.571 CB 1.888 106 residues pruned to eliminate duplicates Z: 96 86.327 2.723 0.785 0.535 0.926 0.653 CB 1.901 96 residues pruned to eliminate duplicates Z: 26 47.172 2.653 0.815 0.686 0.840 0.760 CA 1.967 26 residues pruned to eliminate duplicates Z: 101 74.164 2.670 0.663 0.491 0.930 0.600 CB 1.813 101 residues pruned to eliminate duplicates Z: 31 35.289 2.592 0.586 0.568 0.833 0.700 CA 1.762 31 residues pruned to eliminate duplicates Z: 31 38.570 2.589 0.505 0.544 0.900 0.633 CA 1.924 31 residues pruned to eliminate duplicates Z: 149 81.591 2.577 0.694 0.488 0.905 0.581 CB 1.717 149 residues pruned to eliminate duplicates Z: 96 69.577 2.622 0.604 0.458 0.926 0.611 CB 1.913 96 residues pruned to eliminate duplicates Z: 63 64.987 2.607 0.719 0.542 0.935 0.694 CB 1.889 63 residues pruned to eliminate duplicates Z: 94 76.169 2.721 0.720 0.513 0.914 0.602 CB 1.822 94 residues pruned to eliminate duplicates Z: 97 83.620 2.715 0.737 0.517 0.938 0.667 CB 1.898 97 residues pruned to eliminate duplicates Z: 80 74.889 2.723 0.762 0.527 0.899 0.595 CB 1.902 80 residues pruned to eliminate duplicates Z: 24 51.412 2.713 0.968 0.717 0.913 0.696 CA 1.806 24 residues pruned to eliminate duplicates Z: 76 75.605 2.665 0.680 0.590 0.947 0.573 CB 1.890 76 residues pruned to eliminate duplicates Z: 28 58.902 2.649 0.871 0.743 0.963 0.704 CB 1.910 28 residues pruned to eliminate duplicates Z: 78 82.628 2.728 0.791 0.571 0.935 0.675 CB 1.925 78 residues pruned to eliminate duplicates Z: 96 83.389 2.719 0.762 0.530 0.937 0.684 CB 1.851 96 residues pruned to eliminate duplicates Z: 77 81.896 2.711 0.793 0.556 0.947 0.592 CB 1.932 77 residues pruned to eliminate duplicates Z: 24 64.177 2.685 1.215 0.683 0.913 0.696 CB 2.084 24 residues pruned to eliminate duplicates Z: 80 73.065 2.640 0.710 0.588 0.924 0.582 CB 1.811 80 residues pruned to eliminate duplicates Z: 15 18.768 2.455 0.445 0.364 0.929 0.643 CB 1.763 15 residues pruned to eliminate duplicates Z: 41 28.190 2.350 0.568 0.346 0.850 0.550 CB 1.681 42 residues pruned to eliminate duplicates Z: 6 3.417 1.567 0.629 0.376 0.800 0.600 CA 0.855 6 residues pruned to eliminate duplicates Z: 24 28.559 2.443 0.548 0.446 0.957 0.652 CB 1.740 25 residues pruned to eliminate duplicates Z: 8 5.621 1.638 0.840 0.359 0.857 0.429 CB 0.958 8 residues pruned to eliminate duplicates Z: 42 31.689 2.411 0.615 0.387 0.902 0.512 CB 1.588 40 residues pruned to eliminate duplicates Z: 7 6.971 1.783 0.569 0.434 0.833 0.333 N 1.307 7 residues pruned to eliminate duplicates Z: 55 31.996 2.389 0.415 0.449 0.852 0.556 CB 1.595 55 residues pruned to eliminate duplicates Z: 88 48.591 2.463 0.472 0.473 0.920 0.655 CB 1.606 88 residues pruned to eliminate duplicates Z: 38 26.980 2.392 0.477 0.378 0.892 0.649 CB 1.603 38 residues pruned to eliminate duplicates Z: 56 37.345 2.401 0.468 0.479 0.891 0.691 CB 1.638 56 residues pruned to eliminate duplicates Z: 28 28.100 2.407 0.503 0.448 0.963 0.667 CB 1.638 28 residues pruned to eliminate duplicates Z: 42 31.003 2.405 0.552 0.335 0.951 0.585 CB 1.633 42 residues pruned to eliminate duplicates Z: 38 27.721 2.430 0.505 0.384 0.892 0.568 CB 1.580 38 residues pruned to eliminate duplicates Z: 42 23.683 2.369 0.507 0.294 0.878 0.561 CB 1.485 42 residues pruned to eliminate duplicates Z: 105 56.714 2.484 0.480 0.524 0.904 0.654 CB 1.634 105 residues pruned to eliminate duplicates Z: 43 27.491 2.385 0.452 0.381 0.881 0.619 CB 1.578 43 residues pruned to eliminate duplicates Z: 38 30.415 2.392 0.609 0.379 0.892 0.622 CB 1.657 38 residues pruned to eliminate duplicates Z: 41 27.260 2.442 0.446 0.336 0.875 0.550 CB 1.669 41 residues pruned to eliminate duplicates Z: 24 29.128 2.372 0.549 0.508 0.957 0.696 CB 1.714 24 residues pruned to eliminate duplicates Z: 42 30.514 2.419 0.503 0.360 0.927 0.488 CB 1.643 42 residues pruned to eliminate duplicates Z: 38 30.495 2.435 0.514 0.383 0.892 0.595 CB 1.726 38 residues pruned to eliminate duplicates Z: 71 41.666 2.396 0.542 0.455 0.886 0.571 CB 1.593 71 residues pruned to eliminate duplicates Z: 40 31.293 2.445 0.498 0.384 0.923 0.615 CB 1.677 40 residues pruned to eliminate duplicates Z: 42 22.458 2.328 0.503 0.247 0.854 0.463 CB 1.572 42 residues pruned to eliminate duplicates Z: 39 27.499 2.443 0.456 0.353 0.921 0.579 CB 1.596 39 residues pruned to eliminate duplicates Z: 19 15.236 2.393 0.494 0.255 0.889 0.444 CB 1.497 19 residues pruned to eliminate duplicates Z: 20 15.399 2.335 0.686 0.212 0.895 0.526 CB 1.410 20 residues pruned to eliminate duplicates Z: 44 30.715 2.382 0.607 0.370 0.907 0.605 CB 1.551 44 residues pruned to eliminate duplicates Z: 17 11.721 2.473 0.442 0.245 0.750 0.500 CB 1.470 17 residues pruned to eliminate duplicates Z: 27 23.111 2.392 0.502 0.418 0.923 0.692 CB 1.488 27 residues pruned to eliminate duplicates Z: 73 47.383 2.493 0.527 0.473 0.917 0.625 CB 1.644 73 residues pruned to eliminate duplicates Z: 114 61.035 2.484 0.547 0.488 0.903 0.593 CB 1.676 114 residues pruned to eliminate duplicates Z: 39 29.158 2.460 0.429 0.365 0.895 0.684 CB 1.739 39 residues pruned to eliminate duplicates Z: 87 42.261 2.403 0.491 0.473 0.849 0.547 CB 1.540 87 residues pruned to eliminate duplicates Z: 90 56.656 2.505 0.584 0.532 0.888 0.607 CB 1.652 90 residues pruned to eliminate duplicates Z: 35 26.680 2.406 0.436 0.518 0.824 0.588 CB 1.580 35 residues pruned to eliminate duplicates Z: 76 44.548 2.451 0.452 0.469 0.933 0.493 CB 1.597 76 residues pruned to eliminate duplicates Z: 88 47.780 2.455 0.500 0.463 0.897 0.609 CB 1.610 88 residues pruned to eliminate duplicates Z: 54 37.789 2.469 0.379 0.549 0.943 0.623 CB 1.542 54 residues pruned to eliminate duplicates Z: 89 50.771 2.459 0.547 0.470 0.920 0.614 CB 1.593 89 residues pruned to eliminate duplicates Z: 121 59.441 2.471 0.507 0.480 0.900 0.667 CB 1.651 121 residues pruned to eliminate duplicates Z: 56 35.177 2.452 0.457 0.499 0.855 0.509 CB 1.555 56 residues pruned to eliminate duplicates Z: 94 52.976 2.519 0.469 0.516 0.892 0.570 CB 1.638 94 residues pruned to eliminate duplicates Z: 76 44.335 2.437 0.507 0.464 0.933 0.573 CB 1.549 76 residues pruned to eliminate duplicates Z: 67 45.031 2.439 0.587 0.485 0.955 0.636 CB 1.523 67 residues pruned to eliminate duplicates Z: 61 41.816 2.455 0.531 0.485 0.917 0.617 CB 1.591 61 residues pruned to eliminate duplicates Z: 243 111.972 2.561 0.758 0.553 0.901 0.599 CB 1.686 243 residues pruned to eliminate duplicates Z: 66 44.761 2.471 0.492 0.528 0.938 0.662 CB 1.561 66 residues pruned to eliminate duplicates Z: 92 59.324 2.517 0.575 0.525 0.912 0.659 CB 1.678 92 residues pruned to eliminate duplicates Z: 35 30.446 2.333 0.555 0.595 0.882 0.588 CB 1.489 35 residues pruned to eliminate duplicates Z: 116 65.975 2.484 0.616 0.505 0.922 0.609 CB 1.654 116 residues pruned to eliminate duplicates Z: 82 47.332 2.444 0.531 0.452 0.926 0.568 CB 1.595 82 residues pruned to eliminate duplicates Z: 61 38.201 2.412 0.545 0.505 0.883 0.533 CB 1.490 61 residues pruned to eliminate duplicates Z: 32 33.885 2.354 0.520 0.657 0.968 0.613 CB 1.519 32 residues pruned to eliminate duplicates Z: 78 41.493 2.452 0.408 0.441 0.883 0.481 CB 1.649 78 residues pruned to eliminate duplicates Z: 66 44.022 2.417 0.510 0.528 0.877 0.615 CB 1.660 66 residues pruned to eliminate duplicates Z: 104 48.353 2.417 0.434 0.438 0.942 0.583 CB 1.556 104 residues pruned to eliminate duplicates Z: 114 61.284 2.497 0.548 0.481 0.894 0.584 CB 1.702 114 residues pruned to eliminate duplicates Z: 55 39.835 2.452 0.453 0.529 0.944 0.667 CB 1.566 55 residues pruned to eliminate duplicates Z: 87 46.130 2.469 0.462 0.464 0.895 0.581 CB 1.596 87 residues pruned to eliminate duplicates Z: 36 35.064 2.520 0.521 0.500 0.971 0.571 CB 1.591 36 residues pruned to eliminate duplicates Z: 63 38.586 2.370 0.524 0.501 0.919 0.548 CB 1.474 63 residues pruned to eliminate duplicates Z: 44 40.100 2.531 0.608 0.454 0.953 0.628 CB 1.653 44 residues pruned to eliminate duplicates Z: 84 59.134 2.514 0.571 0.525 0.928 0.639 CB 1.728 84 residues pruned to eliminate duplicates Z: 60 58.779 2.616 0.611 0.524 0.949 0.627 CB 1.869 60 residues pruned to eliminate duplicates Z: 95 57.935 2.508 0.533 0.509 0.883 0.606 CB 1.744 95 residues pruned to eliminate duplicates Z: 119 60.057 2.513 0.503 0.486 0.890 0.627 CB 1.670 119 residues pruned to eliminate duplicates Z: 37 27.767 2.457 0.385 0.422 0.917 0.583 CB 1.609 37 residues pruned to eliminate duplicates Z: 23 22.791 2.522 0.287 0.398 1.000 0.545 CB 1.666 23 residues pruned to eliminate duplicates Z: 51 44.045 2.508 0.501 0.541 0.980 0.720 CB 1.623 51 residues pruned to eliminate duplicates Z: 40 28.792 2.400 0.515 0.387 0.923 0.564 CB 1.548 40 residues pruned to eliminate duplicates Z: 92 46.288 2.415 0.489 0.456 0.934 0.571 CB 1.511 92 residues pruned to eliminate duplicates Z: 57 50.906 2.589 0.533 0.473 0.964 0.643 CB 1.827 57 residues pruned to eliminate duplicates Z: 45 33.215 2.493 0.455 0.442 0.955 0.659 CB 1.536 45 residues pruned to eliminate duplicates Z: 58 38.073 2.464 0.506 0.441 0.930 0.632 CB 1.553 58 residues pruned to eliminate duplicates Z: 72 55.549 2.449 0.723 0.498 0.901 0.690 CB 1.735 72 residues pruned to eliminate duplicates Z: 79 40.092 2.412 0.487 0.454 0.885 0.538 CB 1.500 79 residues pruned to eliminate duplicates Z: 44 39.563 2.531 0.553 0.474 0.977 0.698 CB 1.614 44 residues pruned to eliminate duplicates Z: 51 34.095 2.545 0.406 0.416 0.880 0.560 CB 1.671 51 residues pruned to eliminate duplicates Z: 119 66.969 2.486 0.599 0.499 0.932 0.636 CB 1.666 119 residues pruned to eliminate duplicates Z: 65 43.948 2.497 0.455 0.465 0.938 0.609 CB 1.672 65 residues pruned to eliminate duplicates Z: 44 47.068 2.595 0.609 0.554 0.930 0.628 CA 1.753 44 residues pruned to eliminate duplicates Z: 58 45.373 2.561 0.446 0.470 0.930 0.579 CB 1.798 58 residues pruned to eliminate duplicates Z: 62 54.346 2.595 0.543 0.514 0.951 0.738 CB 1.803 62 residues pruned to eliminate duplicates Z: 120 56.432 2.495 0.473 0.446 0.908 0.639 CB 1.640 120 residues pruned to eliminate duplicates Z: 63 52.024 2.584 0.516 0.491 0.952 0.629 CB 1.788 63 residues pruned to eliminate duplicates Z: 88 57.697 2.535 0.531 0.536 0.897 0.655 CB 1.717 88 residues pruned to eliminate duplicates Z: 99 52.490 2.518 0.472 0.467 0.888 0.612 CB 1.667 99 residues pruned to eliminate duplicates Z: 27 36.548 2.553 0.655 0.509 0.885 0.500 CA 1.900 27 residues pruned to eliminate duplicates Z: 33 40.653 2.640 0.773 0.534 0.812 0.625 CA 1.828 33 residues pruned to eliminate duplicates Z: 118 58.561 2.492 0.559 0.467 0.897 0.598 CB 1.606 118 residues pruned to eliminate duplicates Z: 86 47.709 2.464 0.521 0.462 0.871 0.588 CB 1.649 86 residues pruned to eliminate duplicates Z: 34 32.129 2.469 0.656 0.405 0.879 0.606 CB 1.720 34 residues pruned to eliminate duplicates Z: 181 106.469 2.583 0.796 0.587 0.917 0.672 CB 1.717 181 residues pruned to eliminate duplicates Z: 57 48.155 2.612 0.421 0.515 0.946 0.786 CB 1.804 57 residues pruned to eliminate duplicates Z: 50 39.817 2.572 0.527 0.436 0.939 0.673 CB 1.649 50 residues pruned to eliminate duplicates Z: 62 54.513 2.607 0.642 0.482 0.951 0.672 CB 1.747 62 residues pruned to eliminate duplicates Z: 60 54.471 2.594 0.615 0.505 0.966 0.746 CB 1.742 60 residues pruned to eliminate duplicates Z: 121 64.164 2.503 0.529 0.484 0.925 0.667 CB 1.681 121 residues pruned to eliminate duplicates Z: 33 41.595 2.584 0.601 0.579 0.906 0.719 CA 1.817 33 residues pruned to eliminate duplicates Z: 17 35.051 2.740 0.398 0.802 1.000 0.938 CA 1.758 17 residues pruned to eliminate duplicates Z: 180 91.716 2.554 0.701 0.502 0.899 0.659 CB 1.752 180 residues pruned to eliminate duplicates Z: 129 100.526 2.665 0.918 0.556 0.891 0.602 CB 1.847 129 residues pruned to eliminate duplicates Z: 19 48.649 2.782 1.078 0.760 0.889 0.611 CA 1.771 19 residues pruned to eliminate duplicates Z: 19 56.409 2.653 1.386 0.748 0.944 0.778 CA 1.783 19 residues pruned to eliminate duplicates Z: 47 53.114 2.482 0.764 0.562 0.957 0.587 CB 1.761 47 residues pruned to eliminate duplicates Z: 33 46.981 2.530 1.045 0.559 0.875 0.500 CB 1.733 33 residues pruned to eliminate duplicates Z: 64 52.578 2.579 0.647 0.495 0.921 0.651 CB 1.701 64 residues pruned to eliminate duplicates Z: 77 82.985 2.671 0.876 0.651 0.908 0.658 CA 1.817 77 residues pruned to eliminate duplicates Z: 19 59.459 2.636 1.416 0.763 0.944 0.500 CA 1.844 19 residues pruned to eliminate duplicates Z: 67 102.280 2.738 1.143 0.688 0.955 0.621 CB 1.892 67 residues pruned to eliminate duplicates Z: 65 98.717 2.752 1.008 0.682 0.969 0.641 CA 1.951 65 residues pruned to eliminate duplicates Z: 67 92.157 2.701 0.967 0.689 0.924 0.530 CB 1.942 67 residues pruned to eliminate duplicates Z: 142 92.746 2.546 0.898 0.532 0.901 0.560 CB 1.739 142 residues pruned to eliminate duplicates Z: 213 124.562 2.615 0.874 0.569 0.925 0.594 CB 1.767 213 residues pruned to eliminate duplicates Z: 83 99.543 2.715 1.022 0.644 0.939 0.524 CB 1.864 83 residues pruned to eliminate duplicates Z: 150 114.480 2.664 0.892 0.540 0.946 0.617 CB 1.891 150 residues pruned to eliminate duplicates Z: 59 90.508 2.714 0.984 0.699 0.931 0.638 CA 1.976 59 residues pruned to eliminate duplicates Z: 101 58.950 2.506 0.660 0.490 0.910 0.540 CB 1.573 101 residues pruned to eliminate duplicates Z: 37 61.765 2.679 0.917 0.632 0.944 0.611 CB 1.875 37 residues pruned to eliminate duplicates Z: 172 119.229 2.629 0.931 0.602 0.912 0.637 CB 1.787 172 residues pruned to eliminate duplicates Z: 64 80.114 2.696 0.939 0.625 0.905 0.587 CB 1.897 64 residues pruned to eliminate duplicates Z: 140 88.102 2.579 0.794 0.538 0.921 0.590 CB 1.690 140 residues pruned to eliminate duplicates Z: 18 18.640 2.387 0.349 0.549 0.941 0.471 CB 1.422 18 residues pruned to eliminate duplicates Z: 81 76.540 2.673 0.883 0.591 0.863 0.637 CB 1.806 81 residues pruned to eliminate duplicates Z: 44 66.485 2.694 0.756 0.706 0.953 0.791 CB 1.864 44 residues pruned to eliminate duplicates Z: 59 88.130 2.735 1.093 0.668 0.931 0.707 CB 1.859 59 residues pruned to eliminate duplicates Z: 49 72.625 2.717 0.900 0.711 0.896 0.729 CB 1.872 49 residues pruned to eliminate duplicates Z: 43 64.970 2.587 1.100 0.624 0.905 0.381 CB 1.814 43 residues pruned to eliminate duplicates Z: 147 103.912 2.624 0.800 0.590 0.945 0.603 CB 1.767 147 residues pruned to eliminate duplicates Z: 28 56.190 2.709 1.118 0.656 0.889 0.630 CB 1.834 28 residues pruned to eliminate duplicates Z: 76 77.391 2.642 0.973 0.574 0.880 0.640 CA 1.813 76 residues pruned to eliminate duplicates Z: 146 101.034 2.612 0.770 0.597 0.917 0.628 CB 1.804 146 residues pruned to eliminate duplicates Z: 49 71.880 2.685 0.865 0.716 0.938 0.667 CB 1.818 49 residues pruned to eliminate duplicates Z: 146 103.909 2.616 0.855 0.600 0.903 0.669 CB 1.790 146 residues pruned to eliminate duplicates Z: 173 115.341 2.620 0.875 0.586 0.919 0.581 CB 1.795 173 residues pruned to eliminate duplicates Z: 49 79.192 2.710 1.038 0.705 0.958 0.667 CB 1.793 49 residues pruned to eliminate duplicates Z: 81 86.781 2.693 0.986 0.572 0.863 0.637 CA 1.963 81 residues pruned to eliminate duplicates Z: 60 80.027 2.702 0.992 0.655 0.915 0.661 CB 1.831 60 residues pruned to eliminate duplicates Z: 43 66.972 2.695 0.771 0.726 0.952 0.738 CA 1.854 43 residues pruned to eliminate duplicates Z: 42 75.399 2.752 0.981 0.724 0.878 0.683 CA 2.010 42 residues pruned to eliminate duplicates Z: 149 101.611 2.587 0.805 0.575 0.905 0.622 CB 1.837 149 residues pruned to eliminate duplicates Z: 145 97.058 2.567 0.872 0.573 0.917 0.583 CB 1.711 145 residues pruned to eliminate duplicates Z: 114 102.679 2.658 0.997 0.551 0.903 0.531 CB 1.919 114 residues pruned to eliminate duplicates Z: 56 62.441 2.611 0.896 0.611 0.891 0.491 CB 1.718 56 residues pruned to eliminate duplicates Z: 75 97.018 2.726 1.146 0.618 0.892 0.581 CB 1.934 75 residues pruned to eliminate duplicates Z: 138 97.679 2.561 0.884 0.579 0.927 0.555 CB 1.729 138 residues pruned to eliminate duplicates Z: 39 81.093 2.785 1.033 0.784 0.921 0.553 CB 1.965 39 residues pruned to eliminate duplicates Z: 142 104.519 2.597 0.884 0.611 0.922 0.624 CB 1.757 142 residues pruned to eliminate duplicates Z: 173 110.925 2.596 0.842 0.583 0.913 0.576 CB 1.789 173 residues pruned to eliminate duplicates Z: 53 72.005 2.607 1.002 0.645 0.942 0.577 CB 1.774 53 residues pruned to eliminate duplicates Z: 77 84.203 2.636 1.044 0.622 0.868 0.526 CB 1.840 77 residues pruned to eliminate duplicates Z: 38 75.377 2.707 1.206 0.727 0.919 0.568 CA 1.840 38 residues pruned to eliminate duplicates Z: 47 82.853 2.760 1.084 0.742 0.913 0.565 CA 1.873 47 residues pruned to eliminate duplicates Z: 82 89.653 2.709 0.992 0.603 0.877 0.679 CA 1.909 82 residues pruned to eliminate duplicates Z: 100 103.963 2.671 1.057 0.637 0.899 0.596 CB 1.860 100 residues pruned to eliminate duplicates Z: 74 104.928 2.721 1.129 0.678 0.945 0.534 CB 1.904 74 residues pruned to eliminate duplicates Z: 148 105.734 2.610 0.868 0.600 0.925 0.633 CB 1.757 148 residues pruned to eliminate duplicates Z: 171 125.311 2.644 0.976 0.606 0.918 0.612 CB 1.812 171 residues pruned to eliminate duplicates Z: 139 92.166 2.513 0.851 0.568 0.928 0.638 CB 1.703 139 residues pruned to eliminate duplicates Z: 91 116.516 2.738 1.141 0.653 0.922 0.600 CB 1.970 91 residues pruned to eliminate duplicates Z: 100 98.913 2.683 1.040 0.573 0.889 0.535 CA 1.904 100 residues pruned to eliminate duplicates Z: 76 94.487 2.726 1.045 0.617 0.907 0.480 CB 1.932 76 residues pruned to eliminate duplicates Z: 81 95.461 2.739 1.124 0.593 0.887 0.562 CB 1.890 81 residues pruned to eliminate duplicates Z: 31 56.073 2.707 1.037 0.686 0.900 0.600 CA 1.739 31 residues pruned to eliminate duplicates Z: 148 107.394 2.619 0.856 0.596 0.932 0.639 CB 1.784 148 residues pruned to eliminate duplicates Z: 148 113.142 2.623 0.936 0.602 0.939 0.639 CB 1.776 148 residues pruned to eliminate duplicates Z: 12 27.115 2.334 1.351 0.603 0.727 0.273 N 1.858 12 residues pruned to eliminate duplicates Z: 91 107.184 2.727 1.105 0.617 0.911 0.533 CA 1.933 91 residues pruned to eliminate duplicates Z: 76 96.237 2.726 1.138 0.618 0.907 0.600 CB 1.882 76 residues pruned to eliminate duplicates Z: 73 76.416 2.637 1.084 0.505 0.875 0.500 CB 1.865 73 residues pruned to eliminate duplicates Z: 198 108.037 2.593 0.841 0.528 0.914 0.584 CB 1.716 198 residues pruned to eliminate duplicates Z: 138 114.119 2.620 0.962 0.635 0.927 0.606 CB 1.803 138 residues pruned to eliminate duplicates Z: 150 106.149 2.608 0.898 0.587 0.919 0.604 CB 1.759 150 residues pruned to eliminate duplicates Z: 135 112.302 2.650 0.919 0.640 0.925 0.627 CB 1.809 135 residues pruned to eliminate duplicates Z: 31 48.414 2.593 1.082 0.480 0.900 0.500 CA 1.856 31 residues pruned to eliminate duplicates Z: 111 77.217 2.539 0.865 0.533 0.909 0.655 CB 1.656 111 residues pruned to eliminate duplicates Z: 102 77.942 2.564 0.804 0.542 0.901 0.634 CB 1.787 102 residues pruned to eliminate duplicates Z: 30 46.605 2.764 1.083 0.475 0.828 0.621 CA 1.864 30 residues pruned to eliminate duplicates Z: 147 111.448 2.632 0.934 0.607 0.904 0.658 CB 1.810 147 residues pruned to eliminate duplicates Z: 103 107.248 2.690 1.095 0.617 0.912 0.598 CB 1.850 103 residues pruned to eliminate duplicates Z: 75 90.302 2.761 1.029 0.623 0.905 0.622 CA 1.843 75 residues pruned to eliminate duplicates Z: 127 71.655 2.476 0.758 0.490 0.881 0.563 CB 1.681 127 residues pruned to eliminate duplicates Z: 147 110.120 2.620 0.896 0.593 0.925 0.623 CB 1.816 147 residues pruned to eliminate duplicates Z: 173 116.495 2.628 0.918 0.603 0.895 0.576 CB 1.784 173 residues pruned to eliminate duplicates Z: 77 90.449 2.731 1.016 0.608 0.868 0.645 CB 1.958 77 residues pruned to eliminate duplicates Z: 145 110.131 2.652 0.903 0.599 0.924 0.646 CB 1.791 145 residues pruned to eliminate duplicates Z: 186 110.908 2.596 0.864 0.562 0.892 0.530 CB 1.780 186 residues pruned to eliminate duplicates Z: 100 80.455 2.582 0.822 0.546 0.909 0.626 CA 1.808 100 residues pruned to eliminate duplicates Z: 87 88.369 2.628 1.061 0.556 0.895 0.616 CB 1.862 87 residues pruned to eliminate duplicates Z: 83 87.131 2.702 0.972 0.570 0.890 0.646 CA 1.896 83 residues pruned to eliminate duplicates Z: 149 107.578 2.614 0.877 0.600 0.912 0.628 CB 1.796 149 residues pruned to eliminate duplicates Z: 166 104.741 2.566 0.973 0.549 0.885 0.521 CB 1.735 166 residues pruned to eliminate duplicates Z: 76 93.536 2.732 1.075 0.610 0.907 0.507 CB 1.893 76 residues pruned to eliminate duplicates Z: 149 104.078 2.609 0.812 0.598 0.912 0.635 CB 1.807 149 residues pruned to eliminate duplicates Z: 149 108.058 2.620 0.841 0.602 0.932 0.655 CB 1.792 149 residues pruned to eliminate duplicates Z: 111 91.851 2.617 0.976 0.574 0.909 0.573 CB 1.735 111 residues pruned to eliminate duplicates Z: 74 50.845 2.473 0.640 0.561 0.890 0.644 CB 1.554 74 residues pruned to eliminate duplicates Z: 73 56.989 2.481 0.716 0.576 0.903 0.597 CB 1.624 73 residues pruned to eliminate duplicates Z: 32 34.210 2.445 0.555 0.607 0.903 0.645 CA 1.617 32 residues pruned to eliminate duplicates Z: 145 105.984 2.632 0.889 0.603 0.875 0.639 CB 1.841 145 residues pruned to eliminate duplicates Z: 101 80.053 2.568 0.836 0.516 0.940 0.620 CB 1.777 101 residues pruned to eliminate duplicates Z: 75 55.672 2.458 0.760 0.550 0.892 0.622 CB 1.597 75 residues pruned to eliminate duplicates Z: 73 52.642 2.485 0.585 0.572 0.903 0.597 CB 1.627 73 residues pruned to eliminate duplicates Z: 148 112.233 2.628 0.895 0.608 0.918 0.612 CB 1.825 148 residues pruned to eliminate duplicates Z: 18 35.234 2.501 0.648 0.889 0.941 0.765 CA 1.586 18 residues pruned to eliminate duplicates Z: 93 71.190 2.525 0.792 0.547 0.924 0.620 CB 1.696 93 residues pruned to eliminate duplicates Z: 72 56.691 2.510 0.692 0.556 0.915 0.521 CB 1.638 72 residues pruned to eliminate duplicates Z: 81 50.303 2.411 0.608 0.532 0.913 0.663 CB 1.540 81 residues pruned to eliminate duplicates Z: 75 56.673 2.459 0.728 0.543 0.946 0.635 CB 1.572 75 residues pruned to eliminate duplicates Z: 152 103.617 2.591 0.817 0.570 0.927 0.636 CB 1.805 152 residues pruned to eliminate duplicates Z: 74 50.185 2.463 0.564 0.559 0.918 0.699 CB 1.569 74 residues pruned to eliminate duplicates Z: 71 59.946 2.507 0.729 0.579 0.929 0.729 CB 1.650 71 residues pruned to eliminate duplicates Z: 172 128.662 2.647 0.980 0.606 0.930 0.602 CB 1.825 172 residues pruned to eliminate duplicates Z: 72 60.851 2.513 0.727 0.572 0.944 0.662 CB 1.645 72 residues pruned to eliminate duplicates Z: 100 78.494 2.576 0.744 0.557 0.939 0.646 CB 1.768 100 residues pruned to eliminate duplicates Z: 61 62.678 2.659 0.806 0.563 0.900 0.583 CA 1.761 61 residues pruned to eliminate duplicates Z: 71 55.775 2.512 0.637 0.570 0.914 0.671 CB 1.657 71 residues pruned to eliminate duplicates Z: 74 58.778 2.455 0.775 0.576 0.918 0.685 CB 1.599 74 residues pruned to eliminate duplicates Z: 72 60.472 2.492 0.733 0.595 0.958 0.648 CB 1.584 72 residues pruned to eliminate duplicates Z: 146 113.482 2.648 0.999 0.601 0.883 0.634 CB 1.832 146 residues pruned to eliminate duplicates Z: 73 59.041 2.503 0.678 0.562 0.931 0.625 CB 1.676 73 residues pruned to eliminate duplicates Z: 74 54.649 2.476 0.707 0.562 0.890 0.685 CB 1.600 74 residues pruned to eliminate duplicates Z: 216 119.366 2.596 0.840 0.552 0.935 0.614 CB 1.733 216 residues pruned to eliminate duplicates Z: 146 113.655 2.642 0.945 0.602 0.910 0.628 CB 1.831 146 residues pruned to eliminate duplicates Z: 75 57.174 2.486 0.666 0.558 0.919 0.676 CB 1.650 75 residues pruned to eliminate duplicates Z: 67 60.788 2.497 0.803 0.592 0.909 0.621 CB 1.674 67 residues pruned to eliminate duplicates Z: 75 57.168 2.463 0.613 0.569 0.932 0.662 CB 1.678 75 residues pruned to eliminate duplicates Z: 77 50.122 2.431 0.581 0.537 0.895 0.645 CB 1.612 77 residues pruned to eliminate duplicates Z: 77 53.073 2.411 0.542 0.543 0.934 0.632 CB 1.681 77 residues pruned to eliminate duplicates Z: 72 55.890 2.497 0.672 0.558 0.915 0.662 CB 1.640 72 residues pruned to eliminate duplicates Z: 107 57.720 2.410 0.559 0.528 0.925 0.632 CB 1.571 56 residues pruned to eliminate duplicates Z: 23 39.236 2.254 0.834 0.772 1.000 0.864 CA 1.591 23 residues pruned to eliminate duplicates Z: 144 69.421 2.479 0.661 0.475 0.860 0.580 CB 1.681 106 residues pruned to eliminate duplicates Z: 22 35.562 2.203 0.606 0.824 0.952 0.714 CB 1.740 22 residues pruned to eliminate duplicates Z: 74 51.359 2.452 0.534 0.560 0.932 0.671 CB 1.619 74 residues pruned to eliminate duplicates Z: 73 54.711 2.476 0.647 0.567 0.903 0.639 CB 1.641 73 residues pruned to eliminate duplicates Z: 76 54.888 2.445 0.652 0.546 0.920 0.667 CB 1.631 76 residues pruned to eliminate duplicates Z: 147 104.008 2.625 0.829 0.585 0.918 0.671 CB 1.801 111 residues pruned to eliminate duplicates Z: 19 40.741 2.307 0.744 0.886 1.000 0.722 CB 1.722 19 residues pruned to eliminate duplicates Z: 72 55.835 2.501 0.627 0.579 0.915 0.676 CB 1.649 72 residues pruned to eliminate duplicates Z: 173 115.106 2.615 0.904 0.587 0.901 0.605 CB 1.799 148 residues pruned to eliminate duplicates Z: 19 37.577 2.377 0.694 0.907 0.944 0.944 CB 1.654 19 residues pruned to eliminate duplicates Z: 73 56.063 2.491 0.685 0.561 0.917 0.681 CB 1.618 73 residues pruned to eliminate duplicates Z: 173 112.722 2.601 0.937 0.570 0.913 0.529 CB 1.746 173 residues pruned to eliminate duplicates Z: 18 49.743 2.424 0.999 0.908 1.000 0.824 CA 1.768 18 residues pruned to eliminate duplicates Z: 109 74.551 2.548 0.808 0.525 0.917 0.657 CB 1.658 109 residues pruned to eliminate duplicates Z: 72 57.288 2.498 0.682 0.581 0.944 0.634 CB 1.587 72 residues pruned to eliminate duplicates Z: 32 39.909 2.378 0.940 0.582 0.935 0.581 CB 1.535 32 residues pruned to eliminate duplicates Z: 76 56.679 2.442 0.642 0.565 0.960 0.653 CB 1.596 76 residues pruned to eliminate duplicates Z: 75 60.401 2.485 0.726 0.574 0.946 0.622 CB 1.612 75 residues pruned to eliminate duplicates Z: 70 61.054 2.523 0.721 0.589 0.942 0.652 CB 1.650 70 residues pruned to eliminate duplicates Z: 146 108.003 2.638 0.907 0.600 0.917 0.621 CB 1.767 146 residues pruned to eliminate duplicates Z: 153 112.099 2.624 0.926 0.584 0.934 0.618 CB 1.776 153 residues pruned to eliminate duplicates Z: 74 60.567 2.487 0.738 0.569 0.932 0.630 CB 1.647 74 residues pruned to eliminate duplicates Z: 72 68.733 2.518 0.824 0.601 0.944 0.690 CB 1.709 91 residues pruned to eliminate duplicates Z: 7 6.241 1.579 0.498 0.476 1.000 0.667 CA 1.104 7 residues pruned to eliminate duplicates Z: 74 57.177 2.475 0.639 0.569 0.959 0.644 CB 1.609 74 residues pruned to eliminate duplicates Z: 150 113.475 2.602 1.002 0.594 0.933 0.584 CB 1.749 150 residues pruned to eliminate duplicates Z: 143 107.819 2.610 0.904 0.615 0.923 0.620 CB 1.771 143 residues pruned to eliminate duplicates Z: 16 16.793 2.393 0.370 0.343 0.933 0.467 CA 1.681 16 residues pruned to eliminate duplicates Z: 11 4.758 2.112 0.347 0.106 0.900 0.200 CB 0.969 11 residues pruned to eliminate duplicates Z: 145 112.982 2.654 0.871 0.609 0.931 0.681 CB 1.837 145 residues pruned to eliminate duplicates Z: 87 63.419 2.520 0.663 0.550 0.907 0.651 CA 1.714 87 residues pruned to eliminate duplicates Z: 146 114.909 2.639 0.929 0.599 0.938 0.655 CB 1.818 146 residues pruned to eliminate duplicates 1454 residues left after pruning, divided into chains as follows: A: 40 B: 9 C: 19 D: 11 E: 22 F: 15 G: 112 H: 9 I: 18 J: 19 K: 7 L: 221 M: 22 N: 7 O: 29 P: 6 Q: 70 R: 129 S: 26 T: 198 U: 196 V: 251 W: 18 Residues blocked in groups of 7 to fit allocated memory (-u) CC for partial structure against native data = 30.63 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 1.094, Connect. = 0.785 for dens.mod. cycle 1 = 0.300, Contrast = 1.180, Connect. = 0.796 for dens.mod. cycle 2 = 0.300, Contrast = 1.415, Connect. = 0.813 for dens.mod. cycle 3 = 0.300, Contrast = 1.406, Connect. = 0.812 for dens.mod. cycle 4 = 0.300, Contrast = 1.397, Connect. = 0.812 for dens.mod. cycle 5 = 0.300, Contrast = 1.374, Connect. = 0.812 for dens.mod. cycle 6 = 0.300, Contrast = 1.356, Connect. = 0.813 for dens.mod. cycle 7 = 0.300, Contrast = 1.339, Connect. = 0.813 for dens.mod. cycle 8 = 0.300, Contrast = 1.324, Connect. = 0.813 for dens.mod. cycle 9 = 0.300, Contrast = 1.310, Connect. = 0.813 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 16994 peaks > 0.5 sigma used to seed fragment search Space for about 6134 unique residues taking solvent into account 2510 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 20 49.117 2.590 0.817 0.852 1.000 0.737 CA 1.771 B: 20 64.165 2.708 1.103 0.897 0.947 0.842 CA 1.953 20 residues pruned to eliminate duplicates C: 22 45.572 2.543 0.643 0.882 0.952 0.857 CA 1.809 22 residues pruned to eliminate duplicates D: 23 59.271 2.590 1.330 0.881 0.864 0.364 CA 1.755 E: 24 69.643 2.705 1.134 0.910 1.000 0.522 CA 1.784 22 residues pruned to eliminate duplicates F: 94 57.538 2.530 0.652 0.426 0.935 0.548 CB 1.647 G: 26 56.764 2.593 1.166 0.854 0.960 0.520 CA 1.556 26 residues pruned to eliminate duplicates H: 25 59.927 2.456 1.118 0.905 1.000 0.875 CA 1.674 I: 25 51.471 2.697 0.631 0.915 1.000 0.833 CA 1.688 25 residues pruned to eliminate duplicates J: 21 51.319 2.571 0.816 0.864 0.950 0.800 CA 1.896 21 residues pruned to eliminate duplicates K: 9 30.065 2.452 0.975 0.818 1.000 0.625 CA 1.664 L: 26 78.596 2.792 1.274 0.908 0.960 0.560 CA 1.832 M: 26 56.527 2.766 0.879 0.895 0.960 0.680 CA 1.624 26 residues pruned to eliminate duplicates N: 27 89.499 2.679 1.472 0.889 1.000 0.500 CA 1.908 26 residues pruned to eliminate duplicates O: 9 20.923 2.234 0.464 0.841 1.000 0.750 CA 1.686 9 residues pruned to eliminate duplicates P: 22 35.083 2.336 0.504 0.936 1.000 0.952 CA 1.517 22 residues pruned to eliminate duplicates Q: 22 45.265 2.468 0.759 0.892 0.952 0.714 CA 1.716 22 residues pruned to eliminate duplicates R: 19 81.032 2.842 1.232 0.937 1.000 0.833 CA 2.096 19 residues pruned to eliminate duplicates S: 26 45.914 2.493 0.751 0.908 0.960 0.760 CA 1.557 26 residues pruned to eliminate duplicates T: 25 65.909 2.863 0.989 0.909 0.958 0.833 CA 1.750 25 residues pruned to eliminate duplicates U: 25 66.468 2.529 1.355 0.867 0.958 0.708 CA 1.739 25 residues pruned to eliminate duplicates V: 25 41.257 2.519 0.712 0.873 1.000 0.708 CA 1.423 W: 20 47.954 2.707 0.622 0.915 1.000 0.895 CA 1.770 20 residues pruned to eliminate duplicates X: 20 78.811 2.676 1.405 0.920 1.000 0.789 CA 1.979 20 residues pruned to eliminate duplicates Y: 6 11.133 2.050 0.697 0.753 1.000 0.800 CA 1.143 6 residues pruned to eliminate duplicates Z: 97 48.072 2.403 0.540 0.387 0.948 0.521 CB 1.576 Z: 20 33.392 2.536 0.339 0.922 0.947 0.947 CA 1.674 Z: 23 55.634 2.767 1.025 0.901 0.955 0.773 CA 1.582 23 residues pruned to eliminate duplicates Z: 26 56.389 2.737 0.801 0.879 0.960 0.760 CA 1.728 26 residues pruned to eliminate duplicates Z: 135 89.272 2.590 0.636 0.590 0.940 0.619 CB 1.776 34 residues pruned to eliminate duplicates Z: 20 65.418 2.600 1.319 0.872 0.947 0.684 CA 1.914 20 residues pruned to eliminate duplicates Z: 25 78.854 2.849 1.302 0.903 0.917 0.542 CA 1.909 25 residues pruned to eliminate duplicates Z: 19 33.393 2.372 0.565 0.943 1.000 0.722 CA 1.469 19 residues pruned to eliminate duplicates Z: 9 25.228 2.493 0.703 0.880 0.875 0.875 CB 1.739 Z: 27 48.493 2.409 0.938 0.895 0.962 0.808 CA 1.518 27 residues pruned to eliminate duplicates Z: 10 18.507 2.294 0.559 0.794 0.778 0.778 CB 1.714 10 residues pruned to eliminate duplicates Z: 10 15.066 2.147 0.375 0.766 0.889 0.778 CB 1.512 Z: 20 29.139 2.474 0.484 0.831 1.000 0.842 CA 1.369 Z: 20 34.530 2.482 0.710 0.901 1.000 0.789 CA 1.333 20 residues pruned to eliminate duplicates Z: 24 59.202 2.664 0.972 0.880 0.913 0.565 CB 1.865 Z: 26 45.184 2.455 0.829 0.873 0.960 0.840 CA 1.527 25 residues pruned to eliminate duplicates Z: 22 52.067 2.666 0.919 0.910 1.000 0.810 CA 1.575 22 residues pruned to eliminate duplicates Z: 51 89.091 2.652 1.403 0.660 1.000 0.560 CA 1.704 Z: 6 10.555 2.164 0.458 0.855 0.800 0.800 C 1.380 Z: 9 18.790 2.405 0.621 0.711 0.875 0.750 CA 1.609 9 residues pruned to eliminate duplicates Z: 18 56.204 2.703 1.047 0.896 1.000 0.588 CB 1.765 18 residues pruned to eliminate duplicates Z: 10 23.342 2.207 0.792 0.829 1.000 0.667 CA 1.481 10 residues pruned to eliminate duplicates Z: 24 46.987 2.591 0.774 0.924 0.870 0.696 CB 1.721 24 residues pruned to eliminate duplicates Z: 25 57.646 2.747 0.840 0.899 0.917 0.750 CA 1.815 25 residues pruned to eliminate duplicates Z: 25 85.178 2.852 1.337 0.897 0.958 0.625 CA 1.948 25 residues pruned to eliminate duplicates Z: 18 36.799 2.484 0.826 0.914 1.000 0.765 CA 1.391 18 residues pruned to eliminate duplicates Z: 24 52.759 2.688 0.732 0.888 0.957 0.870 CA 1.780 23 residues pruned to eliminate duplicates Z: 9 24.661 2.447 0.679 0.872 1.000 0.750 CA 1.546 9 residues pruned to eliminate duplicates Z: 9 14.005 2.338 0.311 0.724 0.875 0.625 CA 1.509 9 residues pruned to eliminate duplicates Z: 26 41.073 2.422 0.979 0.849 0.960 0.680 CA 1.324 25 residues pruned to eliminate duplicates Z: 19 55.618 2.719 1.394 0.864 0.944 0.667 CA 1.564 19 residues pruned to eliminate duplicates Z: 27 64.697 2.694 0.949 0.887 1.000 0.731 CA 1.743 27 residues pruned to eliminate duplicates Z: 9 28.162 2.357 0.764 0.841 1.000 0.875 CA 1.787 Z: 27 55.832 2.546 0.971 0.919 0.962 0.615 CA 1.600 27 residues pruned to eliminate duplicates Z: 18 53.655 2.715 0.853 0.940 0.941 0.706 CA 1.908 18 residues pruned to eliminate duplicates Z: 12 26.619 2.419 1.128 0.883 1.000 0.909 CA 1.127 Z: 14 24.993 2.282 1.053 0.709 0.923 0.462 CA 1.325 14 residues pruned to eliminate duplicates Z: 19 25.510 2.356 0.374 0.905 1.000 0.944 CA 1.322 19 residues pruned to eliminate duplicates Z: 8 22.381 2.617 0.774 0.854 0.857 0.571 CA 1.569 Z: 9 21.883 2.487 0.532 0.803 0.875 0.875 CA 1.781 9 residues pruned to eliminate duplicates Z: 22 73.939 2.782 1.237 0.909 1.000 0.810 CA 1.840 22 residues pruned to eliminate duplicates Z: 19 34.730 2.558 0.370 0.924 1.000 0.944 CA 1.640 20 residues pruned to eliminate duplicates Z: 18 63.344 2.862 0.897 0.913 0.941 0.706 CA 2.129 18 residues pruned to eliminate duplicates Z: 23 75.454 2.802 1.312 0.902 1.000 0.636 CA 1.771 23 residues pruned to eliminate duplicates Z: 6 13.541 1.938 0.986 0.692 1.000 0.600 CA 1.320 Z: 25 58.335 2.818 1.072 0.894 1.000 0.833 CA 1.463 25 residues pruned to eliminate duplicates Z: 8 41.566 2.781 1.225 0.842 1.000 0.429 CA 1.891 Z: 21 42.081 2.530 0.685 0.861 0.950 0.850 CA 1.706 21 residues pruned to eliminate duplicates Z: 7 6.563 2.394 0.257 0.431 0.667 0.500 O 1.433 Z: 15 43.466 2.909 0.852 0.913 1.000 1.000 CA 1.526 15 residues pruned to eliminate duplicates Z: 14 24.326 2.081 1.065 0.795 0.846 0.692 CA 1.433 14 residues pruned to eliminate duplicates Z: 24 67.086 2.692 1.082 0.919 1.000 0.565 CB 1.760 25 residues pruned to eliminate duplicates Z: 7 20.916 2.566 0.374 0.848 1.000 0.667 CA 1.796 Z: 26 51.967 2.674 0.839 0.916 0.960 0.840 CA 1.554 26 residues pruned to eliminate duplicates Z: 13 24.159 2.567 0.217 0.927 1.000 0.917 CA 1.565 13 residues pruned to eliminate duplicates Z: 14 24.457 2.170 0.517 0.816 0.923 0.769 CB 1.697 Z: 18 48.928 2.769 0.632 0.946 1.000 1.000 CA 1.816 18 residues pruned to eliminate duplicates Z: 99 52.102 2.450 0.522 0.440 0.898 0.602 CB 1.671 13 residues pruned to eliminate duplicates Z: 20 83.197 2.722 1.361 0.909 1.000 0.632 CA 2.107 20 residues pruned to eliminate duplicates Z: 13 27.717 2.232 0.748 0.820 0.917 0.667 CA 1.695 13 residues pruned to eliminate duplicates Z: 43 67.867 2.565 1.038 0.721 0.881 0.405 CB 1.862 24 residues pruned to eliminate duplicates Z: 6 6.705 1.933 0.259 0.707 0.800 0.600 CA 1.275 6 residues pruned to eliminate duplicates Z: 20 67.320 2.716 1.252 0.907 0.895 0.684 CA 2.006 20 residues pruned to eliminate duplicates Z: 20 68.591 2.722 1.055 0.908 1.000 0.789 CA 1.998 20 residues pruned to eliminate duplicates Z: 25 50.243 2.629 0.844 0.912 0.875 0.792 CA 1.712 25 residues pruned to eliminate duplicates Z: 19 34.079 2.435 0.623 0.898 1.000 0.889 CA 1.454 Z: 10 24.346 2.248 1.094 0.778 1.000 0.444 CA 1.349 Z: 26 38.077 2.532 0.514 0.887 0.960 0.800 CA 1.492 26 residues pruned to eliminate duplicates Z: 34 36.631 2.659 0.678 0.420 0.848 0.515 CB 1.832 34 residues pruned to eliminate duplicates Z: 20 40.645 2.464 0.840 0.884 1.000 0.789 CA 1.486 20 residues pruned to eliminate duplicates Z: 20 63.840 2.594 1.309 0.896 0.895 0.579 CA 1.957 20 residues pruned to eliminate duplicates Z: 67 39.094 2.447 0.486 0.450 0.909 0.652 CB 1.533 66 residues pruned to eliminate duplicates Z: 26 65.913 2.732 1.007 0.939 1.000 0.960 CA 1.671 26 residues pruned to eliminate duplicates Z: 10 29.152 2.558 0.757 0.841 0.889 0.556 N 1.814 Z: 26 53.484 2.721 1.170 0.871 0.920 0.800 CA 1.437 26 residues pruned to eliminate duplicates Z: 26 58.068 2.552 1.169 0.851 0.920 0.400 CA 1.688 26 residues pruned to eliminate duplicates Z: 25 58.416 2.784 0.953 0.917 1.000 0.833 CA 1.547 25 residues pruned to eliminate duplicates Z: 20 40.996 2.442 0.657 0.871 0.947 0.737 CA 1.790 19 residues pruned to eliminate duplicates Z: 24 45.814 2.569 0.877 0.850 0.870 0.696 CB 1.687 27 residues pruned to eliminate duplicates Z: 13 28.536 2.276 0.714 0.830 1.000 0.833 CB 1.587 13 residues pruned to eliminate duplicates Z: 24 50.462 2.764 0.639 0.906 0.957 0.870 CA 1.726 24 residues pruned to eliminate duplicates Z: 19 59.633 2.791 1.619 0.889 0.889 0.722 CA 1.557 19 residues pruned to eliminate duplicates Z: 21 58.787 2.563 0.948 0.907 1.000 0.700 CA 1.871 21 residues pruned to eliminate duplicates Z: 12 24.515 2.331 0.608 0.865 0.909 0.818 CB 1.590 12 residues pruned to eliminate duplicates Z: 11 29.751 2.418 0.934 0.889 0.900 0.800 CA 1.610 11 residues pruned to eliminate duplicates Z: 7 15.160 2.496 0.464 0.738 0.833 0.500 CB 1.641 Z: 20 26.926 2.155 0.592 0.841 0.842 0.684 CA 1.595 Z: 17 43.272 2.696 0.851 0.910 1.000 0.875 CA 1.538 17 residues pruned to eliminate duplicates Z: 94 57.881 2.498 0.576 0.445 0.935 0.634 CB 1.725 97 residues pruned to eliminate duplicates Z: 17 36.190 2.736 0.358 0.913 1.000 0.938 CA 1.723 17 residues pruned to eliminate duplicates Z: 20 49.291 2.617 0.880 0.895 0.895 0.789 CA 1.841 19 residues pruned to eliminate duplicates Z: 66 65.536 2.673 0.748 0.543 0.877 0.646 CA 1.902 47 residues pruned to eliminate duplicates Z: 10 11.981 2.385 0.624 0.560 0.667 0.444 CA 1.458 10 residues pruned to eliminate duplicates Z: 10 23.587 2.620 0.792 0.885 1.000 0.889 CA 1.209 10 residues pruned to eliminate duplicates Z: 24 52.632 2.670 1.057 0.875 0.913 0.478 CA 1.593 25 residues pruned to eliminate duplicates Z: 25 59.780 2.654 1.189 0.931 0.917 0.792 CA 1.601 25 residues pruned to eliminate duplicates Z: 19 39.676 2.305 0.688 0.897 0.944 0.722 CA 1.822 20 residues pruned to eliminate duplicates Z: 26 48.496 2.470 1.108 0.870 0.960 0.840 CA 1.417 24 residues pruned to eliminate duplicates Z: 8 21.935 2.465 0.731 0.869 1.000 1.000 CA 1.420 8 residues pruned to eliminate duplicates Z: 19 54.906 2.685 0.739 0.919 1.000 0.611 CA 1.954 19 residues pruned to eliminate duplicates Z: 23 51.190 2.689 0.895 0.937 0.864 0.591 CA 1.726 23 residues pruned to eliminate duplicates Z: 19 38.431 2.537 0.516 0.886 1.000 0.778 CA 1.699 Z: 25 56.694 2.534 1.109 0.887 0.958 0.708 CA 1.630 25 residues pruned to eliminate duplicates Z: 98 78.624 2.655 0.634 0.545 0.918 0.619 CB 1.919 66 residues pruned to eliminate duplicates Z: 19 35.250 2.397 0.389 0.875 1.000 0.556 CA 1.815 18 residues pruned to eliminate duplicates Z: 9 28.632 2.363 0.687 0.867 1.000 0.875 CB 1.857 9 residues pruned to eliminate duplicates Z: 115 95.421 2.644 0.919 0.618 0.895 0.579 CA 1.762 70 residues pruned to eliminate duplicates Z: 9 26.690 2.251 1.258 0.737 0.875 0.500 CA 1.715 8 residues pruned to eliminate duplicates Z: 122 91.096 2.618 0.745 0.588 0.942 0.645 CA 1.769 122 residues pruned to eliminate duplicates Z: 13 18.351 2.092 0.117 0.883 1.000 0.917 CA 1.640 13 residues pruned to eliminate duplicates Z: 23 66.377 2.888 1.177 0.932 0.955 0.545 CA 1.647 23 residues pruned to eliminate duplicates Z: 19 49.544 2.684 0.684 0.916 1.000 0.667 CA 1.826 19 residues pruned to eliminate duplicates Z: 19 27.907 2.394 0.424 0.893 0.944 0.833 CA 1.466 19 residues pruned to eliminate duplicates Z: 23 52.771 2.789 1.090 0.875 0.955 0.591 CA 1.471 23 residues pruned to eliminate duplicates Z: 24 60.504 2.774 1.008 0.940 1.000 0.783 CA 1.573 24 residues pruned to eliminate duplicates Z: 9 15.445 2.337 0.282 0.775 0.750 0.750 CA 1.906 9 residues pruned to eliminate duplicates Z: 30 36.244 2.504 1.059 0.580 0.828 0.414 CB 1.460 30 residues pruned to eliminate duplicates Z: 20 43.870 2.472 0.795 0.898 1.000 0.895 CA 1.623 20 residues pruned to eliminate duplicates Z: 75 58.721 2.599 0.568 0.499 0.946 0.581 CB 1.772 75 residues pruned to eliminate duplicates Z: 7 18.024 2.400 0.646 0.498 1.000 0.667 CA 1.866 7 residues pruned to eliminate duplicates Z: 18 49.223 2.523 0.957 0.870 1.000 0.529 CB 1.765 19 residues pruned to eliminate duplicates Z: 6 6.729 1.875 0.264 0.648 0.800 0.800 CA 1.382 6 residues pruned to eliminate duplicates Z: 10 27.475 2.590 1.182 0.878 1.000 0.889 CA 1.177 10 residues pruned to eliminate duplicates Z: 18 50.830 2.532 1.040 0.918 1.000 0.765 CA 1.683 18 residues pruned to eliminate duplicates Z: 22 36.226 2.211 0.620 0.888 1.000 0.762 CA 1.591 Z: 25 68.524 2.479 1.503 0.906 1.000 0.708 CB 1.604 26 residues pruned to eliminate duplicates Z: 11 35.276 2.203 1.344 0.884 0.900 0.700 C 1.734 9 residues pruned to eliminate duplicates Z: 9 17.935 2.342 1.018 0.816 0.750 0.750 CA 1.359 8 residues pruned to eliminate duplicates Z: 52 89.073 2.705 1.294 0.679 0.980 0.529 CA 1.739 51 residues pruned to eliminate duplicates Z: 13 17.732 2.642 0.482 0.381 0.833 0.583 CA 1.781 13 residues pruned to eliminate duplicates Z: 20 32.355 2.315 0.537 0.866 1.000 0.895 CA 1.527 20 residues pruned to eliminate duplicates Z: 24 91.394 2.724 1.582 0.904 0.957 0.522 CA 2.018 24 residues pruned to eliminate duplicates Z: 20 35.919 2.469 0.459 0.862 1.000 0.789 CA 1.680 20 residues pruned to eliminate duplicates Z: 24 68.796 2.788 1.397 0.901 0.870 0.565 CA 1.762 24 residues pruned to eliminate duplicates Z: 159 83.414 2.486 0.682 0.515 0.930 0.601 CB 1.681 154 residues pruned to eliminate duplicates Z: 17 58.997 2.697 1.326 0.884 0.938 0.438 CA 1.812 18 residues pruned to eliminate duplicates Z: 21 56.287 2.541 1.260 0.888 0.900 0.600 CA 1.755 24 residues pruned to eliminate duplicates Z: 23 59.931 2.764 0.871 0.927 0.955 0.773 CA 1.814 23 residues pruned to eliminate duplicates Z: 20 52.791 2.644 0.821 0.906 0.947 0.789 CA 1.888 20 residues pruned to eliminate duplicates Z: 7 23.412 2.619 0.756 0.762 0.833 0.833 N 1.976 7 residues pruned to eliminate duplicates Z: 25 48.093 2.510 0.985 0.877 0.875 0.542 CA 1.636 25 residues pruned to eliminate duplicates Z: 13 26.634 2.113 0.749 0.850 0.917 0.667 CA 1.681 Z: 67 46.891 2.454 0.654 0.465 0.924 0.621 CB 1.594 67 residues pruned to eliminate duplicates Z: 19 32.301 2.080 0.701 0.852 1.000 0.833 CB 1.592 Z: 19 27.901 2.224 0.517 0.837 0.944 0.944 CA 1.543 19 residues pruned to eliminate duplicates Z: 7 24.310 2.454 0.879 0.784 0.833 0.500 CB 2.011 7 residues pruned to eliminate duplicates Z: 24 40.965 2.492 0.546 0.916 1.000 0.913 CA 1.566 24 residues pruned to eliminate duplicates Z: 26 45.504 2.573 0.696 0.899 0.920 0.680 CA 1.620 26 residues pruned to eliminate duplicates Z: 9 15.922 2.298 0.809 0.670 0.875 0.750 CB 1.323 9 residues pruned to eliminate duplicates Z: 59 86.534 2.735 1.210 0.681 0.897 0.621 CA 1.776 59 residues pruned to eliminate duplicates Z: 10 13.270 2.306 0.689 0.617 0.667 0.444 CA 1.525 10 residues pruned to eliminate duplicates Z: 14 26.383 2.121 0.876 0.874 1.000 0.615 CA 1.338 14 residues pruned to eliminate duplicates Z: 15 30.200 2.643 0.942 0.893 0.929 0.857 CA 1.215 15 residues pruned to eliminate duplicates Z: 6 7.454 1.952 0.567 0.495 0.800 0.600 CB 1.369 Z: 24 73.233 2.799 1.388 0.923 1.000 0.870 CA 1.605 24 residues pruned to eliminate duplicates Z: 51 73.065 2.690 1.100 0.678 0.920 0.480 CA 1.688 51 residues pruned to eliminate duplicates Z: 27 68.398 2.693 1.135 0.920 0.923 0.654 CA 1.781 27 residues pruned to eliminate duplicates Z: 26 69.358 2.738 1.529 0.857 0.920 0.600 CA 1.605 26 residues pruned to eliminate duplicates Z: 19 50.642 2.713 0.711 0.898 1.000 0.611 CA 1.840 19 residues pruned to eliminate duplicates Z: 25 36.414 2.607 0.473 0.928 1.000 0.917 CA 1.355 25 residues pruned to eliminate duplicates Z: 25 65.068 2.665 1.478 0.920 0.958 0.667 CA 1.478 25 residues pruned to eliminate duplicates Z: 22 34.179 2.210 0.588 0.915 1.000 1.000 CA 1.502 22 residues pruned to eliminate duplicates Z: 40 51.920 2.415 0.751 0.721 0.897 0.744 CA 1.795 61 residues pruned to eliminate duplicates Z: 20 42.493 2.482 0.747 0.856 1.000 0.789 CA 1.658 20 residues pruned to eliminate duplicates Z: 10 15.263 2.489 0.625 0.403 0.778 0.444 N 1.792 Z: 139 96.253 2.603 0.737 0.552 0.949 0.681 CB 1.814 129 residues pruned to eliminate duplicates Z: 10 27.221 2.175 1.371 0.796 0.889 0.667 CB 1.528 10 residues pruned to eliminate duplicates Z: 9 21.508 2.333 1.120 0.782 0.875 0.500 CA 1.371 9 residues pruned to eliminate duplicates Z: 6 4.753 2.042 0.432 0.651 0.600 0.600 CA 1.053 6 residues pruned to eliminate duplicates Z: 18 35.482 2.296 0.632 0.883 0.941 0.824 CA 1.764 Z: 14 25.728 2.233 0.684 0.848 0.923 0.692 CB 1.525 14 residues pruned to eliminate duplicates Z: 9 12.729 2.329 0.407 0.741 0.750 0.500 CA 1.476 9 residues pruned to eliminate duplicates Z: 8 18.491 2.367 0.444 0.864 1.000 0.857 CA 1.499 Z: 19 49.068 2.699 0.686 0.914 0.944 0.667 CB 1.902 20 residues pruned to eliminate duplicates Z: 10 15.889 2.179 0.606 0.662 0.889 0.556 CA 1.466 10 residues pruned to eliminate duplicates Z: 13 32.889 2.872 0.862 0.912 1.000 0.833 CA 1.257 13 residues pruned to eliminate duplicates Z: 21 74.521 2.756 1.258 0.919 0.950 0.650 CA 1.986 21 residues pruned to eliminate duplicates Z: 23 47.555 2.681 0.656 0.777 0.909 0.864 CA 1.966 23 residues pruned to eliminate duplicates Z: 26 50.549 2.558 0.721 0.927 1.000 0.840 CA 1.609 26 residues pruned to eliminate duplicates Z: 18 46.173 2.523 0.824 0.915 1.000 0.765 CB 1.719 19 residues pruned to eliminate duplicates Z: 21 67.723 2.732 1.373 0.886 0.900 0.400 CB 1.873 22 residues pruned to eliminate duplicates Z: 65 42.283 2.460 0.522 0.468 0.906 0.578 CB 1.610 65 residues pruned to eliminate duplicates Z: 26 70.086 2.691 1.528 0.862 0.840 0.640 CA 1.801 25 residues pruned to eliminate duplicates Z: 21 45.999 2.292 0.964 0.866 1.000 0.800 CA 1.672 21 residues pruned to eliminate duplicates Z: 18 30.457 2.381 0.393 0.903 0.941 0.824 CA 1.687 Z: 14 22.658 2.125 1.048 0.751 0.846 0.615 CA 1.364 10 residues pruned to eliminate duplicates Z: 35 24.116 2.282 0.513 0.364 0.941 0.588 CB 1.474 33 residues pruned to eliminate duplicates Z: 8 29.686 2.548 0.777 0.832 0.857 0.286 N 2.171 7 residues pruned to eliminate duplicates Z: 120 85.034 2.620 0.669 0.529 0.941 0.664 CB 1.840 104 residues pruned to eliminate duplicates Z: 26 57.403 2.508 1.299 0.848 0.920 0.600 CB 1.605 26 residues pruned to eliminate duplicates Z: 32 38.889 2.359 0.713 0.633 0.903 0.581 CB 1.690 18 residues pruned to eliminate duplicates Z: 10 18.499 2.048 0.449 0.861 0.889 0.889 CA 1.718 10 residues pruned to eliminate duplicates Z: 21 60.772 2.497 1.190 0.879 1.000 0.350 CA 1.802 20 residues pruned to eliminate duplicates Z: 38 41.408 2.578 0.774 0.426 0.946 0.649 CA 1.700 32 residues pruned to eliminate duplicates Z: 23 52.429 2.615 1.128 0.887 0.864 0.545 CB 1.678 23 residues pruned to eliminate duplicates Z: 25 80.168 2.691 1.337 0.885 0.958 0.458 CA 1.961 25 residues pruned to eliminate duplicates Z: 66 90.180 2.798 1.007 0.665 0.877 0.615 CA 1.949 58 residues pruned to eliminate duplicates Z: 213 117.637 2.600 0.757 0.560 0.929 0.613 CB 1.795 197 residues pruned to eliminate duplicates Z: 9 20.956 2.309 0.506 0.891 1.000 0.875 CA 1.532 9 residues pruned to eliminate duplicates Z: 17 71.103 2.930 1.296 0.946 0.938 0.750 CA 1.950 17 residues pruned to eliminate duplicates Z: 27 69.470 2.711 1.133 0.904 0.923 0.654 CA 1.817 27 residues pruned to eliminate duplicates Z: 23 37.281 2.540 0.442 0.733 0.955 0.636 CB 1.843 23 residues pruned to eliminate duplicates Z: 18 35.824 2.415 0.507 0.932 0.941 0.824 CA 1.770 18 residues pruned to eliminate duplicates Z: 27 56.158 2.581 1.040 0.885 0.962 0.692 CA 1.570 27 residues pruned to eliminate duplicates Z: 15 16.916 1.947 0.751 0.747 0.786 0.571 CA 1.353 15 residues pruned to eliminate duplicates Z: 20 32.600 2.201 0.414 0.895 1.000 0.789 CA 1.722 20 residues pruned to eliminate duplicates Z: 26 80.288 2.638 1.581 0.882 0.960 0.440 CB 1.778 26 residues pruned to eliminate duplicates Z: 20 48.575 2.408 0.934 0.875 1.000 0.684 CA 1.740 19 residues pruned to eliminate duplicates Z: 136 92.462 2.601 0.816 0.566 0.896 0.652 CA 1.763 136 residues pruned to eliminate duplicates Z: 16 23.513 2.575 0.423 0.514 1.000 0.333 CB 1.633 16 residues pruned to eliminate duplicates Z: 9 17.858 2.351 0.202 0.811 1.000 0.750 CA 1.705 9 residues pruned to eliminate duplicates Z: 25 58.938 2.766 0.782 0.899 1.000 0.833 CA 1.745 25 residues pruned to eliminate duplicates Z: 24 55.389 2.869 1.165 0.881 0.913 0.739 CA 1.474 24 residues pruned to eliminate duplicates Z: 20 40.743 2.408 0.700 0.882 1.000 0.947 CA 1.653 20 residues pruned to eliminate duplicates Z: 87 69.911 2.643 0.599 0.531 0.930 0.581 CB 1.860 87 residues pruned to eliminate duplicates Z: 20 39.436 2.290 0.628 0.876 1.000 0.474 CB 1.763 20 residues pruned to eliminate duplicates Z: 18 34.576 2.127 0.826 0.839 0.941 0.529 CA 1.713 18 residues pruned to eliminate duplicates Z: 37 53.792 2.444 1.006 0.695 0.917 0.528 CA 1.670 26 residues pruned to eliminate duplicates Z: 9 14.237 2.257 0.626 0.676 0.750 0.500 CB 1.555 9 residues pruned to eliminate duplicates Z: 25 40.583 2.542 0.686 0.869 0.875 0.625 CA 1.614 25 residues pruned to eliminate duplicates Z: 25 54.741 2.651 0.872 0.902 0.958 0.500 CA 1.676 25 residues pruned to eliminate duplicates Z: 15 24.005 2.429 0.406 0.922 1.000 0.929 CA 1.321 15 residues pruned to eliminate duplicates Z: 14 28.662 2.306 0.739 0.813 0.923 0.692 CB 1.635 14 residues pruned to eliminate duplicates Z: 27 47.283 2.520 0.541 0.889 1.000 0.808 CA 1.719 27 residues pruned to eliminate duplicates Z: 6 5.981 1.756 0.533 0.637 1.000 0.600 N 0.874 6 residues pruned to eliminate duplicates Z: 19 35.067 2.509 0.398 0.905 1.000 0.944 CA 1.678 19 residues pruned to eliminate duplicates Z: 22 27.132 2.142 0.628 0.836 0.905 0.762 CA 1.404 Z: 21 43.589 2.507 0.618 0.853 1.000 0.550 CA 1.777 21 residues pruned to eliminate duplicates Z: 27 39.716 2.586 0.675 0.879 0.962 0.808 CA 1.357 27 residues pruned to eliminate duplicates Z: 19 48.256 2.480 0.907 0.942 1.000 0.667 CA 1.668 19 residues pruned to eliminate duplicates Z: 6 12.194 1.955 0.522 0.775 1.000 0.800 CB 1.438 6 residues pruned to eliminate duplicates Z: 21 73.452 2.942 1.151 0.930 0.950 0.650 CA 1.910 21 residues pruned to eliminate duplicates Z: 10 7.965 2.348 -0.031 0.399 1.000 0.333 CB 1.299 8 residues pruned to eliminate duplicates Z: 18 45.551 2.563 1.028 0.892 0.941 0.529 CA 1.623 18 residues pruned to eliminate duplicates Z: 7 11.360 2.212 0.180 0.802 0.833 0.500 N 1.637 7 residues pruned to eliminate duplicates Z: 26 56.803 2.559 1.121 0.831 0.920 0.640 CA 1.709 26 residues pruned to eliminate duplicates Z: 8 16.171 2.199 0.330 0.868 0.857 0.571 CB 1.782 8 residues pruned to eliminate duplicates Z: 24 59.844 2.835 1.159 0.917 0.913 0.739 CA 1.576 24 residues pruned to eliminate duplicates Z: 8 23.846 2.767 0.615 0.873 0.714 0.714 CB 2.057 8 residues pruned to eliminate duplicates Z: 54 55.672 2.563 0.699 0.612 0.925 0.642 CB 1.708 31 residues pruned to eliminate duplicates Z: 25 51.899 2.703 0.646 0.901 1.000 0.875 CA 1.700 25 residues pruned to eliminate duplicates Z: 6 12.315 1.765 1.143 0.702 1.000 0.800 CA 1.212 6 residues pruned to eliminate duplicates Z: 97 100.013 2.711 0.890 0.628 0.927 0.625 CB 1.906 97 residues pruned to eliminate duplicates Z: 10 23.285 2.113 0.975 0.853 1.000 0.556 CA 1.375 10 residues pruned to eliminate duplicates Z: 58 55.610 2.529 0.737 0.498 0.930 0.667 CB 1.807 58 residues pruned to eliminate duplicates Z: 21 40.361 2.201 0.926 0.893 0.900 0.750 CA 1.698 20 residues pruned to eliminate duplicates Z: 19 27.108 2.350 0.701 0.892 0.944 0.833 CA 1.216 11 residues pruned to eliminate duplicates Z: 71 59.787 2.677 0.558 0.501 0.929 0.629 CB 1.844 71 residues pruned to eliminate duplicates Z: 20 65.744 2.674 1.268 0.879 0.895 0.368 CA 2.016 21 residues pruned to eliminate duplicates Z: 9 34.826 2.441 1.002 0.867 1.000 0.500 CA 1.843 9 residues pruned to eliminate duplicates Z: 8 14.275 2.326 0.199 0.874 1.000 0.857 CA 1.408 Z: 24 51.409 2.573 1.093 0.884 0.870 0.565 CA 1.654 24 residues pruned to eliminate duplicates Z: 22 39.400 2.202 0.821 0.854 0.952 0.857 CA 1.663 22 residues pruned to eliminate duplicates Z: 10 19.050 2.033 0.863 0.708 0.889 0.778 CA 1.561 10 residues pruned to eliminate duplicates Z: 26 71.513 2.573 1.277 0.915 1.000 0.680 CA 1.725 35 residues pruned to eliminate duplicates Z: 20 28.444 2.163 0.417 0.881 0.947 0.947 CA 1.627 20 residues pruned to eliminate duplicates Z: 25 47.478 2.499 1.026 0.859 0.958 0.750 CA 1.470 24 residues pruned to eliminate duplicates Z: 11 20.021 2.293 0.150 0.887 1.000 0.800 CB 1.731 11 residues pruned to eliminate duplicates Z: 43 49.891 2.673 0.719 0.486 0.952 0.714 CB 1.784 43 residues pruned to eliminate duplicates Z: 167 78.249 2.499 0.669 0.483 0.886 0.639 CB 1.673 156 residues pruned to eliminate duplicates Z: 24 53.209 2.694 0.764 0.907 0.957 0.696 CA 1.735 24 residues pruned to eliminate duplicates Z: 21 21.200 2.440 0.231 0.449 0.900 0.450 CB 1.847 Z: 25 83.228 2.785 1.413 0.926 0.958 0.833 CA 1.850 25 residues pruned to eliminate duplicates Z: 6 9.420 1.680 0.755 0.815 1.000 0.800 CA 1.087 6 residues pruned to eliminate duplicates Z: 25 47.571 2.705 0.698 0.890 0.917 0.792 CA 1.660 25 residues pruned to eliminate duplicates Z: 9 13.212 2.250 0.458 0.756 0.875 0.875 CB 1.295 9 residues pruned to eliminate duplicates Z: 35 32.520 2.531 0.843 0.428 0.824 0.500 CA 1.565 35 residues pruned to eliminate duplicates Z: 19 40.100 2.393 0.622 0.935 1.000 0.944 CA 1.697 19 residues pruned to eliminate duplicates Z: 20 37.624 2.329 0.661 0.889 1.000 0.947 CA 1.606 20 residues pruned to eliminate duplicates Z: 8 27.724 2.315 1.595 0.718 0.857 0.429 CA 1.671 8 residues pruned to eliminate duplicates Z: 10 23.499 2.063 1.414 0.764 0.778 0.667 CB 1.601 10 residues pruned to eliminate duplicates Z: 20 33.462 2.262 0.450 0.859 1.000 0.789 CA 1.722 20 residues pruned to eliminate duplicates Z: 25 29.064 2.235 0.703 0.707 0.875 0.625 CA 1.475 19 residues pruned to eliminate duplicates Z: 20 36.427 2.275 0.465 0.882 1.000 0.789 CA 1.814 20 residues pruned to eliminate duplicates Z: 7 21.093 2.685 0.781 0.836 0.667 0.500 CB 2.021 7 residues pruned to eliminate duplicates Z: 114 106.065 2.702 0.909 0.576 0.920 0.593 CB 1.954 114 residues pruned to eliminate duplicates Z: 98 59.757 2.492 0.635 0.438 0.938 0.660 CB 1.693 98 residues pruned to eliminate duplicates Z: 53 64.619 2.578 0.926 0.641 0.923 0.654 CB 1.713 53 residues pruned to eliminate duplicates Z: 27 36.273 2.446 0.539 0.891 0.885 0.654 CA 1.535 27 residues pruned to eliminate duplicates Z: 19 38.982 2.510 0.551 0.860 1.000 0.722 CA 1.736 19 residues pruned to eliminate duplicates Z: 11 15.423 2.554 0.218 0.604 0.800 0.700 CA 1.774 11 residues pruned to eliminate duplicates Z: 9 16.366 2.280 0.449 0.866 1.000 0.875 CA 1.282 9 residues pruned to eliminate duplicates Z: 19 28.149 2.460 0.304 0.838 0.944 0.889 CA 1.637 19 residues pruned to eliminate duplicates Z: 13 25.619 2.246 0.779 0.879 0.917 0.833 CA 1.464 13 residues pruned to eliminate duplicates Z: 22 33.085 2.090 0.830 0.881 0.952 0.667 CA 1.434 22 residues pruned to eliminate duplicates Z: 78 60.306 2.502 0.596 0.589 0.909 0.688 CA 1.739 78 residues pruned to eliminate duplicates Z: 24 54.855 2.799 1.038 0.893 0.870 0.522 CA 1.655 24 residues pruned to eliminate duplicates Z: 11 20.898 2.479 0.325 0.784 0.900 0.900 CA 1.741 11 residues pruned to eliminate duplicates Z: 23 35.395 2.211 0.853 0.881 1.000 0.682 CA 1.334 23 residues pruned to eliminate duplicates Z: 7 9.567 2.071 1.040 0.662 0.667 0.500 CA 1.194 7 residues pruned to eliminate duplicates Z: 26 49.117 2.464 1.139 0.879 0.960 0.560 CA 1.408 26 residues pruned to eliminate duplicates Z: 7 13.651 2.379 0.144 0.849 1.000 0.833 CA 1.517 7 residues pruned to eliminate duplicates Z: 19 57.966 2.806 0.751 0.934 1.000 0.889 CA 1.939 Z: 106 62.818 2.482 0.616 0.499 0.876 0.629 CB 1.747 160 residues pruned to eliminate duplicates Z: 10 6.320 2.236 0.103 0.354 0.778 0.333 CB 1.285 10 residues pruned to eliminate duplicates Z: 19 41.027 2.425 0.599 0.920 0.944 0.889 CA 1.861 19 residues pruned to eliminate duplicates Z: 18 56.555 2.482 1.214 0.939 1.000 0.471 CB 1.735 18 residues pruned to eliminate duplicates Z: 9 13.881 2.092 0.388 0.721 0.875 0.500 N 1.581 9 residues pruned to eliminate duplicates Z: 25 42.807 2.546 0.765 0.882 1.000 0.875 CA 1.408 Z: 11 19.648 2.000 0.965 0.812 0.900 0.500 CB 1.339 11 residues pruned to eliminate duplicates Z: 7 30.856 2.680 0.728 0.846 1.000 0.500 CA 2.020 7 residues pruned to eliminate duplicates Z: 12 27.871 2.319 0.401 0.900 1.000 0.909 CB 1.847 12 residues pruned to eliminate duplicates Z: 14 31.643 2.237 1.102 0.823 0.923 0.615 CA 1.529 14 residues pruned to eliminate duplicates Z: 8 17.444 2.293 1.490 0.722 0.714 0.571 CA 1.323 8 residues pruned to eliminate duplicates Z: 68 45.718 2.413 0.635 0.445 0.955 0.582 CB 1.569 70 residues pruned to eliminate duplicates Z: 19 42.964 2.415 0.743 0.904 1.000 0.611 CA 1.714 19 residues pruned to eliminate duplicates Z: 19 35.533 2.433 0.628 0.811 0.944 0.778 CA 1.707 19 residues pruned to eliminate duplicates Z: 20 26.039 2.270 0.351 0.914 0.895 0.684 CA 1.540 20 residues pruned to eliminate duplicates Z: 9 22.999 2.356 0.854 0.807 0.875 0.375 CA 1.627 9 residues pruned to eliminate duplicates Z: 35 33.004 2.229 0.638 0.615 0.882 0.559 CB 1.576 25 residues pruned to eliminate duplicates Z: 11 30.115 2.493 0.975 0.882 0.900 0.600 CB 1.556 10 residues pruned to eliminate duplicates Z: 20 41.012 2.411 0.656 0.875 1.000 0.632 CA 1.713 20 residues pruned to eliminate duplicates Z: 11 34.683 2.207 1.080 0.877 1.000 0.400 CA 1.735 10 residues pruned to eliminate duplicates Z: 18 42.369 2.557 0.665 0.890 1.000 0.765 CA 1.737 18 residues pruned to eliminate duplicates Z: 131 95.532 2.633 0.804 0.554 0.931 0.531 CB 1.799 131 residues pruned to eliminate duplicates Z: 25 55.480 2.559 1.228 0.866 0.875 0.500 CA 1.663 25 residues pruned to eliminate duplicates Z: 6 7.174 1.726 0.512 0.679 1.000 0.600 CA 1.043 6 residues pruned to eliminate duplicates Z: 7 9.270 2.130 0.621 0.574 1.000 0.333 CB 1.021 Z: 8 24.515 2.618 0.511 0.889 1.000 0.857 CB 1.687 8 residues pruned to eliminate duplicates Z: 72 63.166 2.628 0.684 0.505 0.915 0.563 CB 1.841 72 residues pruned to eliminate duplicates Z: 19 38.337 2.521 0.610 0.897 0.944 0.722 CA 1.687 19 residues pruned to eliminate duplicates Z: 6 11.839 2.375 0.559 0.703 1.000 0.600 CA 1.189 6 residues pruned to eliminate duplicates Z: 7 9.822 1.475 0.815 0.840 1.000 0.667 CA 1.118 7 residues pruned to eliminate duplicates Z: 10 26.732 2.055 1.105 0.912 1.000 0.778 CB 1.459 10 residues pruned to eliminate duplicates Z: 26 46.211 2.572 0.572 0.932 1.000 0.800 CA 1.597 26 residues pruned to eliminate duplicates Z: 25 55.839 2.508 1.230 0.916 0.958 0.750 CA 1.502 24 residues pruned to eliminate duplicates Z: 74 67.147 2.485 0.999 0.612 0.904 0.562 CB 1.573 74 residues pruned to eliminate duplicates Z: 18 30.465 2.503 0.749 0.885 1.000 0.824 CA 1.219 18 residues pruned to eliminate duplicates Z: 25 46.407 2.589 1.026 0.907 0.792 0.417 CA 1.621 25 residues pruned to eliminate duplicates Z: 52 54.746 2.565 0.890 0.624 0.863 0.451 CB 1.631 51 residues pruned to eliminate duplicates Z: 62 49.298 2.422 0.884 0.555 0.869 0.590 CB 1.509 Z: 7 3.446 1.669 0.607 0.249 0.667 0.333 CB 1.051 Z: 49 32.037 2.174 0.621 0.563 0.896 0.583 CB 1.377 29 residues pruned to eliminate duplicates Z: 25 40.781 2.508 0.720 0.877 0.958 0.667 CA 1.462 25 residues pruned to eliminate duplicates Z: 51 28.375 2.319 0.398 0.364 0.920 0.580 CB 1.558 51 residues pruned to eliminate duplicates Z: 20 36.213 2.443 0.725 0.888 1.000 0.895 CA 1.420 20 residues pruned to eliminate duplicates Z: 10 19.504 2.151 0.556 0.727 0.889 0.667 CA 1.780 10 residues pruned to eliminate duplicates Z: 9 11.383 2.141 0.503 0.663 0.875 0.750 CB 1.229 9 residues pruned to eliminate duplicates Z: 70 50.718 2.557 0.516 0.459 0.899 0.580 CB 1.827 70 residues pruned to eliminate duplicates Z: 24 57.699 2.606 0.913 0.915 1.000 0.565 CB 1.706 24 residues pruned to eliminate duplicates Z: 14 22.940 2.181 0.524 0.828 0.923 0.692 CB 1.561 14 residues pruned to eliminate duplicates Z: 20 45.646 2.325 0.982 0.913 0.947 0.895 CA 1.697 25 residues pruned to eliminate duplicates Z: 21 34.925 2.285 0.463 0.892 1.000 0.950 CA 1.678 21 residues pruned to eliminate duplicates Z: 10 14.577 2.019 0.305 0.813 0.889 0.889 O 1.581 10 residues pruned to eliminate duplicates Z: 6 8.631 1.811 0.574 0.614 1.000 0.600 N 1.215 6 residues pruned to eliminate duplicates Z: 19 42.852 2.687 0.490 0.942 1.000 0.944 CA 1.750 19 residues pruned to eliminate duplicates Z: 6 5.811 2.216 0.278 0.489 0.600 0.600 N 1.547 6 residues pruned to eliminate duplicates Z: 19 41.574 2.476 0.689 0.890 1.000 0.778 CA 1.686 19 residues pruned to eliminate duplicates Z: 22 38.695 2.227 0.812 0.861 1.000 0.905 CA 1.538 22 residues pruned to eliminate duplicates Z: 26 64.564 2.657 1.349 0.858 0.960 0.520 CA 1.587 26 residues pruned to eliminate duplicates Z: 9 25.966 2.116 0.998 0.870 1.000 0.875 CA 1.585 9 residues pruned to eliminate duplicates Z: 44 32.613 2.180 0.516 0.582 0.884 0.581 CA 1.574 64 residues pruned to eliminate duplicates Z: 11 14.429 2.165 0.805 0.537 0.700 0.700 CB 1.609 Z: 10 14.599 2.097 0.762 0.605 0.889 0.556 CB 1.341 Z: 47 74.840 2.467 0.989 0.888 0.957 0.500 CA 1.694 61 residues pruned to eliminate duplicates Z: 9 14.377 2.268 0.703 0.682 0.750 0.500 CA 1.485 9 residues pruned to eliminate duplicates Z: 25 68.922 2.681 1.569 0.889 0.958 0.625 CA 1.534 25 residues pruned to eliminate duplicates Z: 9 13.229 2.194 0.388 0.771 0.750 0.500 CB 1.611 9 residues pruned to eliminate duplicates Z: 19 37.072 2.205 0.789 0.922 1.000 0.833 CA 1.558 19 residues pruned to eliminate duplicates Z: 41 39.348 2.494 0.653 0.609 0.850 0.650 CB 1.601 41 residues pruned to eliminate duplicates Z: 34 38.144 2.565 0.854 0.448 0.818 0.515 CB 1.800 34 residues pruned to eliminate duplicates Z: 107 102.404 2.724 0.901 0.615 0.925 0.613 CA 1.863 107 residues pruned to eliminate duplicates Z: 26 49.527 2.488 1.218 0.859 0.920 0.680 CA 1.436 26 residues pruned to eliminate duplicates Z: 13 15.305 2.167 0.850 0.469 0.833 0.583 CB 1.364 Z: 32 19.936 2.365 0.439 0.338 0.903 0.581 CB 1.390 32 residues pruned to eliminate duplicates Z: 21 38.469 2.185 1.001 0.799 1.000 0.500 CB 1.514 21 residues pruned to eliminate duplicates Z: 8 17.720 2.510 0.482 0.856 0.857 0.714 CA 1.549 8 residues pruned to eliminate duplicates Z: 7 11.643 1.960 0.973 0.755 1.000 0.833 CA 0.979 7 residues pruned to eliminate duplicates Z: 12 26.791 2.396 0.934 0.798 1.000 0.818 CA 1.342 11 residues pruned to eliminate duplicates Z: 9 18.811 2.255 0.528 0.545 1.000 0.750 CB 1.847 10 residues pruned to eliminate duplicates Z: 6 7.740 1.642 0.883 0.594 0.800 0.600 CA 1.279 Z: 24 46.844 2.638 0.899 0.875 0.913 0.696 CA 1.554 24 residues pruned to eliminate duplicates Z: 13 21.987 2.276 0.424 0.798 0.917 0.750 CB 1.645 13 residues pruned to eliminate duplicates Z: 17 23.099 2.141 0.345 0.904 0.938 0.938 CA 1.523 17 residues pruned to eliminate duplicates Z: 24 61.587 2.813 1.217 0.947 1.000 0.870 CA 1.424 24 residues pruned to eliminate duplicates Z: 17 32.218 2.600 0.638 0.850 0.812 0.625 CA 1.725 17 residues pruned to eliminate duplicates Z: 29 24.650 2.409 0.560 0.383 0.857 0.429 CB 1.638 29 residues pruned to eliminate duplicates Z: 9 18.129 2.320 0.444 0.816 1.000 0.875 CA 1.454 9 residues pruned to eliminate duplicates Z: 12 20.350 2.201 0.736 0.816 0.909 0.818 CB 1.343 12 residues pruned to eliminate duplicates Z: 28 14.607 2.101 0.454 0.329 0.815 0.333 CB 1.361 28 residues pruned to eliminate duplicates Z: 11 21.932 2.222 0.649 0.871 0.900 0.600 CB 1.533 11 residues pruned to eliminate duplicates Z: 27 77.691 2.729 1.250 0.924 1.000 0.615 CA 1.742 27 residues pruned to eliminate duplicates Z: 19 36.023 2.299 0.491 0.910 1.000 0.833 CA 1.757 19 residues pruned to eliminate duplicates Z: 31 28.578 2.232 0.500 0.574 0.900 0.633 CB 1.612 Z: 63 37.076 2.374 0.463 0.483 0.919 0.516 CB 1.500 63 residues pruned to eliminate duplicates Z: 9 9.086 2.147 0.296 0.402 0.875 0.625 CB 1.462 9 residues pruned to eliminate duplicates Z: 19 16.316 2.254 0.355 0.426 0.889 0.444 CB 1.530 Z: 7 5.366 2.038 0.276 0.428 0.667 0.667 CB 1.361 7 residues pruned to eliminate duplicates Z: 8 12.278 2.273 0.471 0.754 0.857 0.571 N 1.291 8 residues pruned to eliminate duplicates Z: 20 26.887 2.197 0.366 0.880 0.947 0.842 CA 1.572 Z: 101 53.853 2.432 0.576 0.452 0.880 0.630 CB 1.677 101 residues pruned to eliminate duplicates Z: 11 16.505 2.090 0.594 0.813 0.800 0.800 CB 1.492 11 residues pruned to eliminate duplicates Z: 45 34.194 2.507 0.473 0.408 0.932 0.545 CB 1.650 45 residues pruned to eliminate duplicates Z: 19 34.610 2.334 0.455 0.905 1.000 0.833 CA 1.710 19 residues pruned to eliminate duplicates Z: 35 44.613 2.520 0.692 0.683 0.941 0.824 CB 1.612 35 residues pruned to eliminate duplicates Z: 10 20.868 2.195 0.422 0.816 1.000 0.889 N 1.693 10 residues pruned to eliminate duplicates Z: 11 19.923 1.964 0.747 0.822 0.900 0.700 CA 1.543 11 residues pruned to eliminate duplicates Z: 49 57.477 2.793 0.443 0.631 0.938 0.729 CA 1.942 49 residues pruned to eliminate duplicates Z: 11 30.085 2.553 0.914 0.847 0.900 0.800 CB 1.606 12 residues pruned to eliminate duplicates Z: 11 14.507 2.019 0.902 0.611 0.800 0.700 N 1.344 11 residues pruned to eliminate duplicates Z: 8 19.887 2.323 1.373 0.762 0.857 0.714 CB 1.261 Z: 13 30.571 2.192 1.076 0.819 0.917 0.667 CA 1.604 13 residues pruned to eliminate duplicates Z: 76 43.904 2.329 0.629 0.404 0.907 0.587 CB 1.631 76 residues pruned to eliminate duplicates Z: 18 51.299 2.708 0.710 0.931 1.000 0.647 CA 1.878 18 residues pruned to eliminate duplicates Z: 8 9.786 2.210 0.217 0.827 1.000 1.000 CB 1.037 8 residues pruned to eliminate duplicates Z: 14 11.917 2.187 0.195 0.502 0.846 0.615 CB 1.493 14 residues pruned to eliminate duplicates Z: 20 42.770 2.428 0.714 0.890 1.000 0.842 CA 1.695 20 residues pruned to eliminate duplicates Z: 55 59.952 2.598 0.749 0.647 0.889 0.593 CA 1.760 55 residues pruned to eliminate duplicates Z: 19 36.012 2.193 1.049 0.939 0.944 0.556 CB 1.390 Z: 18 35.423 2.267 1.109 0.869 0.941 0.765 CB 1.394 18 residues pruned to eliminate duplicates Z: 36 59.756 2.511 1.342 0.752 0.971 0.514 CB 1.413 36 residues pruned to eliminate duplicates Z: 12 23.618 2.407 0.349 0.852 1.000 0.818 CB 1.622 12 residues pruned to eliminate duplicates Z: 11 9.564 2.175 0.391 0.364 0.700 0.300 N 1.653 Z: 10 25.437 2.179 0.908 0.840 0.889 0.667 CB 1.713 10 residues pruned to eliminate duplicates Z: 12 17.215 2.278 0.695 0.835 0.909 0.818 CA 1.108 12 residues pruned to eliminate duplicates Z: 58 82.465 2.735 1.073 0.669 0.895 0.561 CB 1.842 58 residues pruned to eliminate duplicates Z: 20 34.772 2.320 0.682 0.876 1.000 0.684 CA 1.485 20 residues pruned to eliminate duplicates Z: 8 19.791 2.169 0.494 0.874 1.000 1.000 CB 1.680 8 residues pruned to eliminate duplicates Z: 10 20.233 2.155 0.868 0.825 0.778 0.556 CA 1.626 10 residues pruned to eliminate duplicates Z: 22 35.223 2.178 0.628 0.884 0.952 0.619 CB 1.644 22 residues pruned to eliminate duplicates Z: 14 14.472 2.389 0.880 0.230 0.769 0.692 CB 1.591 14 residues pruned to eliminate duplicates Z: 9 14.321 2.150 0.436 0.736 0.875 0.750 CB 1.516 9 residues pruned to eliminate duplicates Z: 20 33.636 2.223 0.509 0.847 1.000 0.789 CA 1.708 20 residues pruned to eliminate duplicates Z: 131 84.902 2.564 0.758 0.561 0.923 0.638 CB 1.687 131 residues pruned to eliminate duplicates Z: 38 42.681 2.500 0.648 0.570 0.946 0.676 CB 1.682 38 residues pruned to eliminate duplicates Z: 66 37.962 2.446 0.487 0.447 0.877 0.585 CB 1.559 66 residues pruned to eliminate duplicates Z: 25 63.012 2.745 1.201 0.892 0.958 0.667 CA 1.596 25 residues pruned to eliminate duplicates Z: 7 2.711 1.789 0.152 0.237 0.667 0.333 CB 1.092 Z: 63 49.918 2.588 0.393 0.561 0.903 0.742 CB 1.835 63 residues pruned to eliminate duplicates Z: 18 32.228 2.323 0.668 0.894 0.941 0.882 CA 1.538 18 residues pruned to eliminate duplicates Z: 102 55.023 2.405 0.556 0.421 0.921 0.584 CB 1.725 102 residues pruned to eliminate duplicates Z: 14 23.817 2.230 0.509 0.774 0.923 0.692 CB 1.669 14 residues pruned to eliminate duplicates Z: 13 33.829 2.278 0.969 0.910 0.917 0.583 CA 1.685 13 residues pruned to eliminate duplicates Z: 63 51.310 2.587 0.643 0.498 0.952 0.613 CB 1.615 63 residues pruned to eliminate duplicates Z: 58 44.538 2.433 0.742 0.485 0.860 0.526 CB 1.643 58 residues pruned to eliminate duplicates Z: 25 77.186 2.783 1.313 0.906 1.000 0.583 CA 1.740 25 residues pruned to eliminate duplicates Z: 13 25.015 1.893 0.762 0.879 1.000 0.750 CA 1.570 13 residues pruned to eliminate duplicates Z: 20 45.550 2.540 1.319 0.869 0.842 0.421 CB 1.539 20 residues pruned to eliminate duplicates Z: 131 100.634 2.645 0.844 0.627 0.892 0.623 CA 1.800 131 residues pruned to eliminate duplicates Z: 9 15.531 2.211 0.324 0.735 1.000 0.750 CB 1.519 9 residues pruned to eliminate duplicates Z: 18 29.705 2.213 0.534 0.891 1.000 0.882 CA 1.527 18 residues pruned to eliminate duplicates Z: 8 25.453 2.376 0.785 0.818 1.000 0.857 CB 1.721 8 residues pruned to eliminate duplicates Z: 13 28.657 2.287 0.552 0.877 0.917 0.667 CB 1.847 13 residues pruned to eliminate duplicates Z: 83 34.500 2.274 0.442 0.446 0.902 0.561 CB 1.361 68 residues pruned to eliminate duplicates Z: 9 12.055 2.125 0.262 0.836 0.750 0.750 CB 1.585 Z: 7 20.395 2.352 0.628 0.844 1.000 0.833 CB 1.619 7 residues pruned to eliminate duplicates Z: 13 28.892 2.228 0.542 0.863 1.000 0.833 CA 1.781 13 residues pruned to eliminate duplicates Z: 6 9.245 1.585 0.646 0.739 1.000 1.000 CB 1.279 6 residues pruned to eliminate duplicates Z: 12 19.705 2.656 0.399 0.551 0.909 0.818 CB 1.674 12 residues pruned to eliminate duplicates Z: 14 26.626 2.164 1.045 0.869 0.846 0.769 CB 1.441 14 residues pruned to eliminate duplicates Z: 25 60.568 2.738 1.137 0.914 0.917 0.667 CA 1.630 25 residues pruned to eliminate duplicates Z: 10 13.011 2.031 0.903 0.548 0.778 0.667 CA 1.377 10 residues pruned to eliminate duplicates Z: 23 35.922 2.603 0.592 0.945 1.000 0.909 CA 1.279 23 residues pruned to eliminate duplicates Z: 22 44.046 2.169 1.009 0.927 1.000 0.810 CA 1.545 Z: 27 61.263 2.603 1.305 0.877 0.923 0.692 CA 1.575 27 residues pruned to eliminate duplicates Z: 21 37.607 2.152 1.020 0.915 0.950 0.800 CB 1.439 21 residues pruned to eliminate duplicates Z: 8 5.477 1.882 0.151 0.313 0.857 0.429 N 1.372 8 residues pruned to eliminate duplicates Z: 25 24.017 2.336 0.510 0.410 1.000 0.583 CB 1.526 25 residues pruned to eliminate duplicates Z: 54 52.713 2.509 0.725 0.599 0.906 0.698 CB 1.681 54 residues pruned to eliminate duplicates Z: 108 99.695 2.680 0.912 0.622 0.897 0.579 CB 1.869 108 residues pruned to eliminate duplicates Z: 21 36.681 2.139 0.901 0.884 0.950 0.700 CB 1.535 21 residues pruned to eliminate duplicates Z: 20 26.333 2.146 0.476 0.864 0.895 0.789 CA 1.563 20 residues pruned to eliminate duplicates Z: 7 8.332 1.661 0.830 0.795 1.000 0.833 CA 0.864 7 residues pruned to eliminate duplicates Z: 8 6.609 2.241 1.037 0.556 0.571 0.429 CB 0.907 8 residues pruned to eliminate duplicates Z: 20 42.996 2.464 0.920 0.909 0.947 0.684 CA 1.563 20 residues pruned to eliminate duplicates Z: 13 26.018 2.114 0.474 0.876 1.000 0.833 CA 1.751 13 residues pruned to eliminate duplicates Z: 88 41.677 2.397 0.437 0.434 0.885 0.598 CB 1.569 88 residues pruned to eliminate duplicates Z: 66 40.664 2.426 0.585 0.453 0.877 0.631 CB 1.569 66 residues pruned to eliminate duplicates Z: 22 37.341 2.228 1.063 0.900 0.905 0.714 CB 1.399 22 residues pruned to eliminate duplicates Z: 15 29.940 2.440 0.904 0.421 0.929 0.643 CA 2.014 15 residues pruned to eliminate duplicates Z: 21 38.726 2.292 0.868 0.918 1.000 0.900 CB 1.426 21 residues pruned to eliminate duplicates Z: 11 26.904 2.631 0.399 0.901 0.900 0.800 CA 1.832 11 residues pruned to eliminate duplicates Z: 19 22.857 2.125 0.292 0.907 0.944 0.889 CA 1.476 19 residues pruned to eliminate duplicates Z: 20 36.078 2.447 0.688 0.871 0.947 0.737 CA 1.542 20 residues pruned to eliminate duplicates Z: 41 39.669 2.557 0.459 0.539 0.900 0.625 CB 1.798 41 residues pruned to eliminate duplicates Z: 8 28.402 2.616 0.837 0.829 1.000 0.714 CA 1.681 8 residues pruned to eliminate duplicates Z: 19 37.849 2.554 0.603 0.885 1.000 0.778 CA 1.573 19 residues pruned to eliminate duplicates Z: 98 55.602 2.422 0.565 0.467 0.907 0.608 CB 1.698 97 residues pruned to eliminate duplicates Z: 85 56.027 2.503 0.680 0.484 0.881 0.595 CB 1.677 85 residues pruned to eliminate duplicates Z: 21 30.904 2.148 0.710 0.907 0.950 0.800 CB 1.407 21 residues pruned to eliminate duplicates Z: 13 10.970 1.786 0.569 0.630 0.833 0.583 CB 1.201 13 residues pruned to eliminate duplicates Z: 8 18.574 2.432 0.672 0.820 0.857 0.714 CB 1.525 8 residues pruned to eliminate duplicates Z: 20 39.127 2.203 0.965 0.928 1.000 0.895 CA 1.452 20 residues pruned to eliminate duplicates Z: 7 13.930 2.234 0.435 0.705 0.833 0.833 CB 1.766 Z: 41 29.399 2.237 0.508 0.548 0.800 0.525 CB 1.643 41 residues pruned to eliminate duplicates Z: 7 9.067 1.573 0.790 0.716 0.833 0.667 CA 1.297 7 residues pruned to eliminate duplicates Z: 23 36.674 2.152 1.256 0.835 0.909 0.455 CB 1.326 23 residues pruned to eliminate duplicates Z: 6 3.762 2.116 0.855 0.593 0.400 0.400 CB 0.980 Z: 22 44.691 2.237 0.974 0.894 1.000 0.667 CA 1.583 22 residues pruned to eliminate duplicates Z: 20 29.452 2.156 0.419 0.885 0.947 0.789 CA 1.682 20 residues pruned to eliminate duplicates Z: 95 74.787 2.654 0.523 0.558 0.926 0.670 CB 1.948 95 residues pruned to eliminate duplicates Z: 23 20.300 2.373 0.401 0.421 0.818 0.545 CB 1.727 21 residues pruned to eliminate duplicates Z: 13 17.011 1.837 0.631 0.821 0.917 0.750 CB 1.354 13 residues pruned to eliminate duplicates Z: 9 9.425 2.207 0.378 0.481 0.875 0.500 CB 1.276 9 residues pruned to eliminate duplicates Z: 94 60.508 2.474 0.672 0.463 0.903 0.634 CB 1.744 94 residues pruned to eliminate duplicates Z: 8 22.111 2.456 0.735 0.739 1.000 0.571 N 1.583 8 residues pruned to eliminate duplicates Z: 55 51.135 2.505 0.729 0.573 0.870 0.685 CA 1.721 55 residues pruned to eliminate duplicates Z: 19 30.971 2.450 0.787 0.504 0.944 0.667 CB 1.758 19 residues pruned to eliminate duplicates Z: 13 17.519 1.828 0.827 0.863 0.833 0.667 CB 1.333 9 residues pruned to eliminate duplicates Z: 54 37.906 2.166 0.617 0.537 0.943 0.585 CB 1.520 47 residues pruned to eliminate duplicates Z: 81 57.342 2.493 0.671 0.497 0.925 0.650 CB 1.669 81 residues pruned to eliminate duplicates Z: 25 56.142 2.524 1.159 0.823 0.958 0.542 CA 1.659 25 residues pruned to eliminate duplicates Z: 13 17.585 2.069 0.343 0.868 1.000 0.750 CB 1.336 13 residues pruned to eliminate duplicates Z: 20 43.009 2.237 0.835 0.886 1.000 0.842 CA 1.734 20 residues pruned to eliminate duplicates Z: 10 12.852 2.010 0.286 0.676 0.889 0.556 CB 1.585 10 residues pruned to eliminate duplicates Z: 74 48.176 2.389 0.678 0.426 0.918 0.562 CB 1.655 74 residues pruned to eliminate duplicates Z: 18 26.250 2.331 0.114 0.905 1.000 0.882 CB 1.744 18 residues pruned to eliminate duplicates Z: 19 42.800 2.418 1.220 0.940 1.000 0.722 CA 1.305 20 residues pruned to eliminate duplicates Z: 18 27.059 2.075 0.531 0.879 0.941 0.824 CA 1.591 18 residues pruned to eliminate duplicates Z: 23 67.559 2.697 1.341 0.912 0.909 0.636 CA 1.777 23 residues pruned to eliminate duplicates Z: 12 20.322 2.053 0.742 0.756 0.909 0.636 N 1.501 12 residues pruned to eliminate duplicates Z: 10 15.489 1.921 0.592 0.850 1.000 0.778 CA 1.251 10 residues pruned to eliminate duplicates Z: 19 41.604 2.274 0.939 0.902 1.000 0.778 CA 1.587 19 residues pruned to eliminate duplicates Z: 8 13.521 2.216 0.205 0.806 0.857 0.571 N 1.709 8 residues pruned to eliminate duplicates Z: 39 24.364 2.277 0.573 0.434 0.842 0.605 CB 1.403 39 residues pruned to eliminate duplicates Z: 7 14.971 2.399 0.323 0.865 1.000 0.833 CB 1.410 7 residues pruned to eliminate duplicates Z: 12 12.434 2.369 0.286 0.316 0.909 0.545 CB 1.658 12 residues pruned to eliminate duplicates Z: 11 17.574 2.329 0.519 0.802 0.800 0.500 CB 1.508 11 residues pruned to eliminate duplicates Z: 7 11.271 2.011 0.648 0.494 0.833 0.333 CB 1.676 Z: 8 24.008 2.562 0.726 0.878 0.857 0.714 N 1.738 8 residues pruned to eliminate duplicates Z: 57 53.656 2.533 0.557 0.661 0.929 0.750 CA 1.686 57 residues pruned to eliminate duplicates Z: 42 34.228 2.316 0.616 0.517 0.927 0.610 CB 1.515 42 residues pruned to eliminate duplicates Z: 13 27.248 2.175 0.726 0.879 1.000 0.583 CB 1.519 14 residues pruned to eliminate duplicates Z: 16 14.299 2.237 0.901 0.479 0.733 0.667 CB 1.210 11 residues pruned to eliminate duplicates Z: 17 34.104 2.464 0.714 0.853 0.938 0.562 CA 1.591 17 residues pruned to eliminate duplicates Z: 19 38.558 2.292 0.809 0.893 1.000 0.778 CB 1.574 19 residues pruned to eliminate duplicates Z: 128 78.353 2.577 0.656 0.493 0.913 0.606 CB 1.796 128 residues pruned to eliminate duplicates Z: 23 21.995 2.215 0.466 0.502 0.909 0.682 CB 1.586 22 residues pruned to eliminate duplicates Z: 20 45.874 2.440 0.878 0.875 1.000 0.579 CB 1.670 20 residues pruned to eliminate duplicates Z: 9 15.396 2.119 0.314 0.739 1.000 0.500 CB 1.578 9 residues pruned to eliminate duplicates Z: 11 20.233 2.149 0.612 0.761 0.900 0.700 CA 1.628 11 residues pruned to eliminate duplicates Z: 8 6.238 1.977 0.399 0.429 0.714 0.571 N 1.285 8 residues pruned to eliminate duplicates Z: 10 28.590 2.150 1.140 0.857 1.000 0.889 CA 1.527 10 residues pruned to eliminate duplicates Z: 12 25.543 2.200 0.455 0.886 1.000 0.909 CB 1.737 12 residues pruned to eliminate duplicates Z: 12 9.033 2.303 0.624 0.384 0.636 0.545 CB 1.295 12 residues pruned to eliminate duplicates Z: 10 18.161 2.072 0.921 0.815 0.889 0.778 CA 1.301 10 residues pruned to eliminate duplicates Z: 9 23.400 2.257 0.705 0.857 1.000 0.750 CA 1.585 9 residues pruned to eliminate duplicates Z: 20 45.007 2.562 0.742 0.885 0.895 0.842 CA 1.867 Z: 60 60.417 2.528 0.845 0.529 0.915 0.559 CA 1.791 60 residues pruned to eliminate duplicates Z: 22 64.500 2.707 1.156 0.927 1.000 0.810 CA 1.689 22 residues pruned to eliminate duplicates Z: 66 45.579 2.433 0.670 0.516 0.877 0.662 CB 1.562 58 residues pruned to eliminate duplicates Z: 12 19.000 2.074 0.488 0.864 0.909 0.727 N 1.497 12 residues pruned to eliminate duplicates Z: 10 11.528 2.437 0.541 0.398 0.667 0.333 N 1.710 10 residues pruned to eliminate duplicates Z: 62 68.648 2.566 1.058 0.617 0.836 0.459 CB 1.783 55 residues pruned to eliminate duplicates Z: 54 46.245 2.541 0.528 0.587 0.887 0.717 CB 1.697 54 residues pruned to eliminate duplicates Z: 88 72.428 2.665 0.661 0.536 0.920 0.563 CB 1.842 88 residues pruned to eliminate duplicates Z: 8 12.948 2.213 0.205 0.879 1.000 0.857 N 1.330 8 residues pruned to eliminate duplicates Z: 34 31.378 2.251 0.611 0.633 0.818 0.667 CB 1.625 34 residues pruned to eliminate duplicates Z: 6 5.351 2.221 0.035 0.449 0.800 0.400 CB 1.371 Z: 8 7.464 2.179 0.739 0.442 0.571 0.429 CB 1.382 8 residues pruned to eliminate duplicates Z: 7 14.227 2.102 0.444 0.874 1.000 1.000 CB 1.393 7 residues pruned to eliminate duplicates Z: 9 17.380 2.113 0.855 0.757 1.000 0.750 CA 1.247 9 residues pruned to eliminate duplicates Z: 13 19.819 2.095 0.295 0.863 0.917 0.833 CB 1.688 13 residues pruned to eliminate duplicates Z: 22 40.736 2.203 0.825 0.908 0.952 0.857 CA 1.649 35 residues pruned to eliminate duplicates Z: 10 28.256 2.138 1.336 0.846 1.000 0.667 CA 1.401 10 residues pruned to eliminate duplicates Z: 14 27.133 2.235 0.829 0.807 0.846 0.615 N 1.664 14 residues pruned to eliminate duplicates Z: 9 6.245 1.900 0.090 0.629 0.750 0.750 CB 1.259 9 residues pruned to eliminate duplicates Z: 28 55.949 2.527 1.270 0.665 0.926 0.407 CA 1.741 28 residues pruned to eliminate duplicates Z: 9 22.617 2.356 0.968 0.840 1.000 0.625 CA 1.287 9 residues pruned to eliminate duplicates Z: 38 45.589 2.630 0.730 0.447 0.919 0.514 CA 1.892 38 residues pruned to eliminate duplicates Z: 31 26.976 2.208 0.340 0.661 0.933 0.833 CB 1.536 33 residues pruned to eliminate duplicates Z: 6 10.659 1.760 0.680 0.856 1.000 0.800 CA 1.190 6 residues pruned to eliminate duplicates Z: 18 27.878 2.156 0.724 0.934 0.941 0.647 CB 1.348 Z: 12 38.471 2.364 1.542 0.846 1.000 0.545 CA 1.433 12 residues pruned to eliminate duplicates Z: 132 113.571 2.668 1.017 0.645 0.908 0.649 CA 1.774 134 residues pruned to eliminate duplicates Z: 10 15.240 2.225 0.285 0.828 0.889 0.778 CA 1.506 10 residues pruned to eliminate duplicates Z: 97 81.979 2.665 0.721 0.551 0.917 0.656 CB 1.895 97 residues pruned to eliminate duplicates Z: 17 36.245 2.431 0.648 0.928 0.875 0.750 CB 1.809 18 residues pruned to eliminate duplicates Z: 20 50.882 2.263 1.240 0.927 1.000 0.789 CB 1.614 21 residues pruned to eliminate duplicates Z: 7 5.688 1.858 0.218 0.743 1.000 0.500 CB 0.826 7 residues pruned to eliminate duplicates Z: 22 39.371 2.244 0.841 0.925 1.000 0.857 CA 1.460 22 residues pruned to eliminate duplicates Z: 21 42.599 2.373 0.842 0.880 1.000 0.700 CA 1.579 21 residues pruned to eliminate duplicates Z: 14 5.893 1.727 0.286 0.235 0.769 0.385 O 1.301 Z: 17 20.144 2.167 0.381 0.879 0.938 0.938 CB 1.302 17 residues pruned to eliminate duplicates Z: 26 80.205 2.729 1.430 0.922 0.960 0.560 CA 1.771 26 residues pruned to eliminate duplicates Z: 17 42.662 2.508 0.954 0.856 1.000 0.812 CB 1.606 17 residues pruned to eliminate duplicates Z: 101 91.363 2.714 0.788 0.625 0.890 0.650 CA 1.881 101 residues pruned to eliminate duplicates Z: 115 72.080 2.581 0.585 0.516 0.930 0.596 CB 1.747 115 residues pruned to eliminate duplicates Z: 7 8.813 1.797 0.496 0.694 1.000 0.667 N 1.121 Z: 104 55.049 2.386 0.585 0.478 0.893 0.583 CB 1.642 105 residues pruned to eliminate duplicates Z: 20 54.014 2.690 0.869 0.907 0.895 0.737 CA 1.959 20 residues pruned to eliminate duplicates Z: 19 35.559 2.277 0.806 0.910 0.944 0.889 CA 1.530 19 residues pruned to eliminate duplicates Z: 17 57.370 2.466 1.107 0.935 1.000 0.688 CB 1.924 19 residues pruned to eliminate duplicates Z: 12 16.500 2.039 0.313 0.839 0.909 0.727 N 1.526 12 residues pruned to eliminate duplicates Z: 24 58.973 2.815 1.268 0.901 0.913 0.609 CA 1.506 24 residues pruned to eliminate duplicates Z: 20 44.313 2.430 0.905 0.829 1.000 0.684 CA 1.653 20 residues pruned to eliminate duplicates Z: 23 59.245 2.613 1.047 0.906 1.000 0.773 CA 1.681 25 residues pruned to eliminate duplicates Z: 77 49.959 2.469 0.672 0.468 0.908 0.697 CB 1.579 77 residues pruned to eliminate duplicates Z: 6 6.384 2.162 0.165 0.456 1.000 0.600 CA 1.185 6 residues pruned to eliminate duplicates Z: 10 12.954 1.966 0.616 0.797 0.889 0.778 CA 1.179 10 residues pruned to eliminate duplicates Z: 126 85.058 2.460 0.765 0.612 0.928 0.624 CB 1.698 125 residues pruned to eliminate duplicates Z: 7 9.870 2.291 0.634 0.612 0.833 0.833 CB 1.161 Z: 22 28.101 2.008 0.653 0.900 1.000 0.857 CB 1.319 20 residues pruned to eliminate duplicates Z: 40 40.920 2.413 0.752 0.495 0.872 0.564 CB 1.787 40 residues pruned to eliminate duplicates Z: 18 37.848 2.546 0.488 0.893 0.941 0.882 CB 1.848 18 residues pruned to eliminate duplicates Z: 36 35.106 2.514 0.391 0.590 0.886 0.600 CB 1.758 36 residues pruned to eliminate duplicates Z: 16 38.941 2.855 1.004 0.934 1.000 0.867 CA 1.226 16 residues pruned to eliminate duplicates Z: 19 10.083 1.973 0.499 0.393 0.778 0.444 CB 1.157 Z: 18 39.023 2.606 0.524 0.913 1.000 0.882 CA 1.686 18 residues pruned to eliminate duplicates Z: 10 18.985 2.171 0.948 0.769 0.778 0.778 CB 1.516 10 residues pruned to eliminate duplicates Z: 6 9.934 1.573 0.953 0.694 1.000 0.800 N 1.211 Z: 65 55.211 2.536 0.883 0.552 0.859 0.547 CB 1.598 65 residues pruned to eliminate duplicates Z: 9 12.744 2.156 0.175 0.791 1.000 0.875 CB 1.377 9 residues pruned to eliminate duplicates Z: 9 7.245 1.911 0.697 0.308 0.750 0.625 O 1.302 Z: 8 15.823 2.305 0.416 0.794 1.000 0.857 CB 1.417 8 residues pruned to eliminate duplicates Z: 14 28.670 2.230 0.717 0.828 0.923 0.692 CA 1.694 14 residues pruned to eliminate duplicates Z: 24 56.000 2.659 0.918 0.903 1.000 0.609 CA 1.631 24 residues pruned to eliminate duplicates Z: 8 25.259 2.356 0.923 0.770 1.000 0.714 CA 1.659 8 residues pruned to eliminate duplicates Z: 15 44.435 2.364 1.350 0.932 1.000 0.857 CA 1.493 15 residues pruned to eliminate duplicates Z: 11 24.485 2.423 0.485 0.901 1.000 0.700 CB 1.536 11 residues pruned to eliminate duplicates Z: 25 41.594 2.596 0.756 0.853 0.917 0.792 CA 1.502 25 residues pruned to eliminate duplicates Z: 25 57.552 2.625 1.040 0.934 0.958 0.708 CA 1.596 25 residues pruned to eliminate duplicates Z: 8 2.784 1.739 0.133 0.257 0.571 0.429 CB 1.235 Z: 7 9.398 1.962 0.719 0.716 1.000 0.500 CB 0.935 7 residues pruned to eliminate duplicates Z: 19 28.275 2.240 0.364 0.919 1.000 0.889 CA 1.537 19 residues pruned to eliminate duplicates Z: 21 46.374 2.242 1.062 0.886 0.950 0.700 CA 1.703 21 residues pruned to eliminate duplicates Z: 18 18.590 2.308 0.489 0.441 0.941 0.471 CB 1.481 19 residues pruned to eliminate duplicates Z: 28 22.131 2.351 0.430 0.377 0.963 0.556 CB 1.499 28 residues pruned to eliminate duplicates Z: 10 24.485 2.117 1.152 0.810 0.889 0.778 CA 1.538 10 residues pruned to eliminate duplicates Z: 8 3.226 1.637 0.360 0.349 0.571 0.571 O 1.129 Z: 20 32.166 2.215 0.656 0.904 0.947 0.842 CA 1.512 20 residues pruned to eliminate duplicates Z: 7 6.839 1.909 0.828 0.373 0.833 0.333 CB 1.100 Z: 6 4.108 1.962 0.538 0.250 0.600 0.400 CB 1.353 Z: 20 35.087 2.215 0.469 0.902 1.000 0.842 CA 1.765 20 residues pruned to eliminate duplicates Z: 98 70.801 2.622 0.575 0.504 0.918 0.557 CB 1.890 98 residues pruned to eliminate duplicates Z: 7 3.084 1.665 0.658 0.404 0.500 0.333 N 1.009 Z: 24 53.944 2.667 0.931 0.868 0.913 0.652 CA 1.748 24 residues pruned to eliminate duplicates Z: 8 9.745 2.400 0.714 0.781 0.571 0.429 CB 1.223 8 residues pruned to eliminate duplicates Z: 20 57.376 2.601 1.143 0.874 0.947 0.632 CA 1.815 20 residues pruned to eliminate duplicates Z: 20 10.864 2.131 0.333 0.258 0.789 0.474 CB 1.467 20 residues pruned to eliminate duplicates Z: 46 46.780 2.495 0.670 0.614 0.867 0.622 CB 1.734 51 residues pruned to eliminate duplicates Z: 22 40.565 2.246 0.880 0.854 0.952 0.667 CB 1.626 22 residues pruned to eliminate duplicates Z: 20 37.434 2.449 0.724 0.861 1.000 0.789 CA 1.495 20 residues pruned to eliminate duplicates Z: 63 81.293 2.649 0.988 0.668 0.919 0.484 CA 1.826 63 residues pruned to eliminate duplicates Z: 21 29.562 2.432 0.860 0.437 0.950 0.500 CB 1.641 21 residues pruned to eliminate duplicates Z: 26 22.586 2.434 0.371 0.412 0.920 0.600 CB 1.612 26 residues pruned to eliminate duplicates Z: 9 23.429 2.403 1.028 0.861 0.875 0.750 CB 1.428 9 residues pruned to eliminate duplicates Z: 73 56.409 2.453 0.631 0.574 0.944 0.639 CB 1.639 64 residues pruned to eliminate duplicates Z: 21 38.736 2.398 0.790 0.877 1.000 0.800 CA 1.465 21 residues pruned to eliminate duplicates Z: 6 23.038 2.404 1.384 0.834 0.800 0.800 CB 1.684 6 residues pruned to eliminate duplicates Z: 19 34.259 2.515 0.376 0.874 1.000 0.833 CA 1.698 19 residues pruned to eliminate duplicates Z: 71 37.270 2.360 0.487 0.449 0.886 0.600 CB 1.509 71 residues pruned to eliminate duplicates Z: 12 18.582 1.978 0.740 0.867 0.818 0.818 N 1.456 12 residues pruned to eliminate duplicates Z: 73 58.053 2.552 0.649 0.488 0.944 0.569 CB 1.742 114 residues pruned to eliminate duplicates Z: 6 11.049 1.710 0.824 0.790 1.000 0.800 N 1.228 6 residues pruned to eliminate duplicates Z: 112 60.150 2.389 0.745 0.492 0.901 0.568 CB 1.533 112 residues pruned to eliminate duplicates Z: 24 28.718 2.065 0.641 0.849 0.957 0.870 CA 1.370 24 residues pruned to eliminate duplicates Z: 22 26.497 2.063 0.413 0.870 0.952 0.905 CB 1.521 22 residues pruned to eliminate duplicates Z: 9 23.008 2.320 0.987 0.861 0.750 0.625 CA 1.729 9 residues pruned to eliminate duplicates Z: 106 64.353 2.436 0.744 0.551 0.867 0.562 CB 1.624 106 residues pruned to eliminate duplicates Z: 18 54.272 2.461 0.957 0.941 1.000 0.588 CB 1.897 17 residues pruned to eliminate duplicates Z: 18 37.824 2.315 0.737 0.914 1.000 0.882 CA 1.614 18 residues pruned to eliminate duplicates Z: 21 39.322 2.137 0.957 0.886 1.000 0.650 CB 1.517 20 residues pruned to eliminate duplicates Z: 45 33.084 2.400 0.518 0.437 0.909 0.523 CB 1.608 45 residues pruned to eliminate duplicates Z: 55 64.065 2.487 1.061 0.714 0.926 0.537 CB 1.513 55 residues pruned to eliminate duplicates Z: 57 39.736 2.446 0.601 0.490 0.911 0.589 CB 1.505 57 residues pruned to eliminate duplicates Z: 20 25.589 1.992 0.797 0.897 1.000 0.632 CA 1.174 Z: 123 78.540 2.578 0.578 0.530 0.910 0.680 CB 1.866 123 residues pruned to eliminate duplicates Z: 15 14.752 2.337 0.343 0.414 0.857 0.714 CB 1.604 15 residues pruned to eliminate duplicates Z: 18 23.072 2.077 0.420 0.815 0.882 0.882 CA 1.636 18 residues pruned to eliminate duplicates Z: 20 34.273 2.405 0.742 0.865 1.000 0.842 CA 1.374 20 residues pruned to eliminate duplicates Z: 118 77.861 2.521 0.825 0.540 0.915 0.538 CB 1.645 118 residues pruned to eliminate duplicates Z: 19 43.658 2.297 1.221 0.943 0.889 0.500 CB 1.572 19 residues pruned to eliminate duplicates Z: 21 29.860 2.054 0.847 0.855 0.950 0.750 CB 1.368 21 residues pruned to eliminate duplicates Z: 8 18.124 2.362 0.802 0.699 0.857 0.429 CA 1.566 8 residues pruned to eliminate duplicates Z: 6 4.903 1.634 0.516 0.553 0.800 0.600 CB 1.051 6 residues pruned to eliminate duplicates Z: 19 25.250 2.102 0.543 0.909 1.000 0.889 CB 1.303 18 residues pruned to eliminate duplicates Z: 12 26.020 2.179 0.572 0.903 1.000 1.000 CB 1.633 12 residues pruned to eliminate duplicates Z: 19 35.043 2.184 0.789 0.903 1.000 0.778 CB 1.507 19 residues pruned to eliminate duplicates Z: 31 41.507 2.365 0.805 0.702 0.933 0.500 CA 1.583 31 residues pruned to eliminate duplicates Z: 10 17.432 2.072 0.393 0.836 1.000 0.667 CA 1.507 10 residues pruned to eliminate duplicates Z: 69 41.050 2.438 0.520 0.456 0.926 0.662 CB 1.517 69 residues pruned to eliminate duplicates Z: 8 14.140 2.190 0.154 0.858 1.000 0.714 CB 1.557 8 residues pruned to eliminate duplicates Z: 17 20.653 2.068 0.825 0.892 0.938 0.688 CB 1.048 17 residues pruned to eliminate duplicates Z: 28 28.264 2.168 0.838 0.631 0.889 0.630 CB 1.358 28 residues pruned to eliminate duplicates Z: 19 49.686 2.416 1.033 0.935 1.000 0.444 CA 1.661 19 residues pruned to eliminate duplicates Z: 10 29.240 2.191 1.069 0.874 1.000 0.667 CA 1.565 10 residues pruned to eliminate duplicates Z: 18 36.733 2.485 0.647 0.933 1.000 0.882 CA 1.519 18 residues pruned to eliminate duplicates Z: 13 17.595 2.422 0.324 0.464 0.917 0.667 CB 1.792 12 residues pruned to eliminate duplicates Z: 23 76.507 2.807 1.480 0.938 1.000 0.682 CA 1.630 23 residues pruned to eliminate duplicates Z: 9 18.463 2.251 0.556 0.863 1.000 1.000 CA 1.367 9 residues pruned to eliminate duplicates Z: 10 27.888 2.321 0.605 0.895 1.000 0.556 CB 1.788 10 residues pruned to eliminate duplicates Z: 47 26.852 2.291 0.518 0.380 0.848 0.587 CB 1.525 47 residues pruned to eliminate duplicates Z: 27 23.171 2.234 0.427 0.571 0.885 0.615 CB 1.505 27 residues pruned to eliminate duplicates Z: 10 35.287 2.547 1.018 0.920 0.889 0.778 CA 1.813 10 residues pruned to eliminate duplicates Z: 74 48.897 2.498 0.574 0.499 0.863 0.562 CB 1.688 74 residues pruned to eliminate duplicates Z: 19 32.006 2.171 0.729 0.876 0.944 0.833 CA 1.546 19 residues pruned to eliminate duplicates Z: 8 12.913 2.180 0.551 0.787 0.857 0.429 CB 1.308 8 residues pruned to eliminate duplicates Z: 13 24.646 2.574 0.387 0.924 1.000 0.917 CA 1.399 13 residues pruned to eliminate duplicates Z: 7 2.787 2.046 -0.153 0.210 0.833 0.333 CB 1.109 Z: 10 17.111 1.996 0.900 0.640 1.000 0.667 CA 1.320 10 residues pruned to eliminate duplicates Z: 19 40.707 2.369 0.798 0.899 0.944 0.556 CA 1.705 19 residues pruned to eliminate duplicates Z: 7 4.457 1.809 0.349 0.518 0.500 0.500 CA 1.465 Z: 21 39.081 2.177 0.869 0.915 1.000 0.750 CB 1.518 21 residues pruned to eliminate duplicates Z: 18 35.317 2.105 0.773 0.885 1.000 0.765 CA 1.657 18 residues pruned to eliminate duplicates Z: 80 72.166 2.543 0.774 0.617 0.949 0.633 CB 1.697 80 residues pruned to eliminate duplicates Z: 53 33.212 2.233 0.452 0.530 0.904 0.673 CB 1.525 53 residues pruned to eliminate duplicates Z: 10 20.909 2.032 1.003 0.793 1.000 0.556 CA 1.324 10 residues pruned to eliminate duplicates Z: 8 21.658 2.306 0.957 0.793 1.000 0.857 CB 1.402 8 residues pruned to eliminate duplicates Z: 9 10.499 2.222 -0.172 0.761 1.000 0.875 CB 1.600 9 residues pruned to eliminate duplicates Z: 21 33.876 2.351 0.651 0.846 0.900 0.650 CA 1.611 21 residues pruned to eliminate duplicates Z: 20 37.075 2.402 0.589 0.859 0.947 0.684 CA 1.732 20 residues pruned to eliminate duplicates Z: 8 16.614 2.448 0.213 0.820 1.000 0.857 CA 1.602 8 residues pruned to eliminate duplicates Z: 64 42.214 2.438 0.473 0.450 0.937 0.540 CB 1.665 64 residues pruned to eliminate duplicates Z: 73 72.224 2.559 0.955 0.571 0.889 0.611 CB 1.786 73 residues pruned to eliminate duplicates Z: 19 33.061 2.269 0.537 0.915 1.000 0.833 CA 1.579 19 residues pruned to eliminate duplicates Z: 8 9.495 2.160 0.149 0.786 0.857 0.857 CA 1.312 8 residues pruned to eliminate duplicates Z: 15 27.466 2.095 0.655 0.894 1.000 0.786 CB 1.518 15 residues pruned to eliminate duplicates Z: 70 33.913 2.381 0.436 0.461 0.884 0.609 CB 1.406 70 residues pruned to eliminate duplicates Z: 6 5.517 2.264 -0.010 0.448 0.800 0.600 CA 1.453 6 residues pruned to eliminate duplicates Z: 8 15.290 2.055 0.853 0.671 1.000 0.714 CA 1.296 8 residues pruned to eliminate duplicates Z: 8 11.721 2.364 0.432 0.587 0.857 0.571 CB 1.404 8 residues pruned to eliminate duplicates Z: 6 6.793 1.974 0.124 0.372 1.000 0.800 CB 1.571 Z: 36 38.490 2.515 0.564 0.633 0.943 0.629 CB 1.549 36 residues pruned to eliminate duplicates Z: 18 36.816 2.303 0.760 0.904 1.000 0.765 CB 1.569 18 residues pruned to eliminate duplicates Z: 19 29.418 2.295 0.185 0.908 1.000 0.833 CA 1.810 19 residues pruned to eliminate duplicates Z: 26 39.904 2.520 0.686 0.880 0.920 0.680 CA 1.479 26 residues pruned to eliminate duplicates Z: 19 36.357 2.222 0.747 0.907 1.000 0.722 CA 1.569 19 residues pruned to eliminate duplicates Z: 20 13.090 2.171 0.390 0.396 0.737 0.632 CB 1.507 19 residues pruned to eliminate duplicates Z: 20 25.519 2.320 0.446 0.630 0.895 0.684 CA 1.727 20 residues pruned to eliminate duplicates Z: 25 20.964 2.131 0.502 0.681 0.875 0.792 CB 1.294 25 residues pruned to eliminate duplicates Z: 15 42.409 2.448 1.350 0.934 0.929 0.714 CA 1.480 15 residues pruned to eliminate duplicates Z: 6 9.459 1.868 0.615 0.797 1.000 0.400 N 1.081 Z: 23 13.783 2.065 0.468 0.332 0.818 0.500 CB 1.423 42 residues pruned to eliminate duplicates Z: 21 37.676 2.239 0.928 0.887 0.950 0.650 CB 1.481 21 residues pruned to eliminate duplicates Z: 29 31.346 2.360 0.513 0.633 0.929 0.714 CB 1.577 29 residues pruned to eliminate duplicates Z: 10 3.207 2.051 0.614 0.164 0.556 0.333 CB 0.875 Z: 24 65.159 2.775 1.296 0.881 0.957 0.696 CA 1.614 24 residues pruned to eliminate duplicates Z: 20 34.960 2.316 0.625 0.903 1.000 0.895 CA 1.519 20 residues pruned to eliminate duplicates Z: 17 31.623 2.292 0.444 0.938 1.000 0.875 CA 1.660 17 residues pruned to eliminate duplicates Z: 7 3.127 1.858 -0.189 0.406 0.833 0.833 N 1.123 Z: 13 23.539 1.870 0.647 0.871 1.000 0.750 N 1.610 12 residues pruned to eliminate duplicates Z: 42 36.058 2.374 0.550 0.481 0.902 0.585 CA 1.729 46 residues pruned to eliminate duplicates Z: 18 29.744 2.333 0.411 0.924 1.000 0.941 CA 1.540 18 residues pruned to eliminate duplicates Z: 128 83.257 2.577 0.734 0.542 0.906 0.646 CB 1.752 128 residues pruned to eliminate duplicates Z: 14 24.900 1.976 1.268 0.868 0.923 0.615 CB 1.220 14 residues pruned to eliminate duplicates Z: 11 7.256 2.106 0.003 0.466 0.800 0.300 CB 1.406 Z: 13 18.564 2.318 0.631 0.418 0.917 0.500 CB 1.685 13 residues pruned to eliminate duplicates Z: 39 35.201 2.478 0.524 0.506 0.895 0.737 CB 1.680 39 residues pruned to eliminate duplicates Z: 19 60.140 2.698 1.271 0.848 0.944 0.500 CA 1.817 19 residues pruned to eliminate duplicates Z: 19 32.820 2.283 0.340 0.921 1.000 0.889 CA 1.779 19 residues pruned to eliminate duplicates Z: 30 43.974 2.442 0.824 0.601 0.931 0.379 CB 1.789 30 residues pruned to eliminate duplicates Z: 23 44.560 2.628 0.761 0.878 0.955 0.909 CA 1.560 23 residues pruned to eliminate duplicates Z: 98 61.075 2.388 0.723 0.475 0.928 0.608 CB 1.665 98 residues pruned to eliminate duplicates Z: 7 9.225 2.295 0.328 0.521 0.833 0.667 N 1.452 7 residues pruned to eliminate duplicates Z: 9 6.262 2.365 0.069 0.449 0.750 0.625 CB 1.231 Z: 60 43.066 2.405 0.502 0.500 0.932 0.525 CB 1.666 60 residues pruned to eliminate duplicates Z: 23 61.061 2.667 1.509 0.897 0.773 0.364 CB 1.803 23 residues pruned to eliminate duplicates Z: 8 8.478 2.109 0.443 0.391 0.857 0.429 CA 1.379 8 residues pruned to eliminate duplicates Z: 19 28.698 2.109 0.793 0.896 0.944 0.667 CB 1.357 19 residues pruned to eliminate duplicates Z: 8 13.738 2.382 0.097 0.853 1.000 0.857 CA 1.469 8 residues pruned to eliminate duplicates Z: 47 31.036 2.411 0.727 0.332 0.870 0.609 CB 1.520 47 residues pruned to eliminate duplicates Z: 151 94.089 2.585 0.784 0.573 0.913 0.547 CB 1.700 151 residues pruned to eliminate duplicates Z: 7 6.373 2.029 0.367 0.389 0.667 0.667 CB 1.582 Z: 96 58.161 2.426 0.603 0.456 0.916 0.600 CB 1.752 96 residues pruned to eliminate duplicates Z: 20 27.547 2.111 0.631 0.853 1.000 0.842 CB 1.356 20 residues pruned to eliminate duplicates Z: 48 40.016 2.486 0.616 0.431 0.936 0.617 CB 1.667 48 residues pruned to eliminate duplicates Z: 101 62.134 2.453 0.568 0.488 0.940 0.690 CB 1.739 99 residues pruned to eliminate duplicates Z: 11 10.571 1.955 0.618 0.621 0.800 0.600 CB 1.178 11 residues pruned to eliminate duplicates Z: 18 20.836 2.044 0.425 0.866 0.824 0.765 CA 1.542 18 residues pruned to eliminate duplicates Z: 19 29.054 2.570 0.580 0.548 0.889 0.611 CB 1.810 19 residues pruned to eliminate duplicates Z: 9 4.676 1.764 0.647 0.302 0.625 0.375 CB 1.135 Z: 178 111.054 2.646 0.717 0.575 0.932 0.605 CB 1.833 178 residues pruned to eliminate duplicates Z: 9 15.577 2.190 0.248 0.730 1.000 0.625 CB 1.638 9 residues pruned to eliminate duplicates Z: 37 21.606 2.262 0.560 0.356 0.861 0.583 CB 1.384 37 residues pruned to eliminate duplicates Z: 12 24.658 2.043 1.008 0.742 0.909 0.636 CB 1.605 11 residues pruned to eliminate duplicates Z: 6 3.946 1.804 0.447 0.308 0.800 0.800 CA 1.045 Z: 17 10.891 2.202 0.330 0.348 0.875 0.500 CB 1.253 17 residues pruned to eliminate duplicates Z: 20 49.969 2.405 1.088 0.894 1.000 0.895 CA 1.638 20 residues pruned to eliminate duplicates Z: 34 43.935 2.498 0.599 0.614 0.909 0.788 CA 1.891 74 residues pruned to eliminate duplicates Z: 7 13.709 2.694 0.716 0.505 0.667 0.333 CB 1.807 7 residues pruned to eliminate duplicates Z: 9 16.364 2.139 0.463 0.753 1.000 0.875 CA 1.476 11 residues pruned to eliminate duplicates Z: 10 14.769 2.193 0.331 0.813 0.889 0.667 N 1.445 10 residues pruned to eliminate duplicates Z: 11 26.060 2.156 0.700 0.858 1.000 0.500 CB 1.656 11 residues pruned to eliminate duplicates Z: 12 22.711 2.137 0.591 0.875 0.909 0.818 CB 1.612 12 residues pruned to eliminate duplicates Z: 17 27.296 2.166 0.429 0.864 0.938 0.750 CB 1.724 17 residues pruned to eliminate duplicates Z: 9 19.668 2.228 1.100 0.811 0.875 0.750 CA 1.296 9 residues pruned to eliminate duplicates Z: 61 47.528 2.478 0.657 0.499 0.933 0.583 CB 1.603 61 residues pruned to eliminate duplicates Z: 19 51.101 2.403 0.949 0.916 1.000 0.333 CA 1.816 18 residues pruned to eliminate duplicates Z: 9 15.143 2.043 0.611 0.867 0.750 0.500 CA 1.586 9 residues pruned to eliminate duplicates Z: 19 27.459 2.262 0.682 0.847 0.889 0.667 CB 1.420 19 residues pruned to eliminate duplicates Z: 8 13.607 2.196 0.054 0.850 1.000 0.714 CA 1.645 8 residues pruned to eliminate duplicates Z: 24 56.313 2.812 1.343 0.897 0.913 0.739 CA 1.398 24 residues pruned to eliminate duplicates Z: 19 40.464 2.520 0.634 0.911 1.000 0.889 CA 1.641 19 residues pruned to eliminate duplicates Z: 95 52.404 2.462 0.460 0.428 0.936 0.521 CB 1.730 95 residues pruned to eliminate duplicates Z: 6 6.682 2.408 0.024 0.444 0.800 0.800 CB 1.605 Z: 10 24.791 2.202 0.775 0.918 1.000 0.444 CB 1.491 11 residues pruned to eliminate duplicates Z: 40 32.504 2.435 0.475 0.558 0.846 0.590 CB 1.618 40 residues pruned to eliminate duplicates Z: 110 75.921 2.496 0.756 0.574 0.917 0.615 CB 1.683 110 residues pruned to eliminate duplicates Z: 36 38.710 2.605 0.615 0.413 0.914 0.514 CB 1.863 36 residues pruned to eliminate duplicates Z: 9 17.846 2.166 0.312 0.842 1.000 0.625 CB 1.655 9 residues pruned to eliminate duplicates Z: 97 52.581 2.448 0.511 0.434 0.896 0.625 CB 1.734 97 residues pruned to eliminate duplicates Z: 9 12.820 2.027 0.229 0.829 1.000 0.750 CB 1.370 9 residues pruned to eliminate duplicates Z: 6 5.155 2.098 0.074 0.715 1.000 0.800 CB 0.842 Z: 22 29.102 2.210 1.009 0.778 0.810 0.619 CA 1.383 22 residues pruned to eliminate duplicates Z: 132 95.848 2.658 0.785 0.637 0.885 0.702 CA 1.753 131 residues pruned to eliminate duplicates Z: 8 14.589 2.353 0.439 0.765 0.857 0.714 CA 1.502 14 residues pruned to eliminate duplicates Z: 12 24.271 2.124 0.739 0.816 0.909 0.727 CB 1.656 12 residues pruned to eliminate duplicates Z: 6 13.640 2.200 0.588 0.651 1.000 0.400 CB 1.517 7 1.596 1.901 0.389 0.244 0.333 0.333 CB 0.995 ? Z: 11 21.358 2.509 0.699 0.801 0.800 0.800 CA 1.522 11 residues pruned to eliminate duplicates Z: 6 7.491 2.058 0.267 0.564 0.800 0.600 N 1.510 Z: 17 25.843 2.142 0.405 0.868 0.938 0.750 CA 1.674 17 residues pruned to eliminate duplicates Z: 8 22.562 2.430 1.229 0.803 0.857 0.571 CB 1.409 8 residues pruned to eliminate duplicates Z: 23 15.617 2.188 0.363 0.359 0.909 0.636 CB 1.430 23 residues pruned to eliminate duplicates Z: 10 23.842 2.055 1.031 0.913 1.000 0.778 CA 1.348 Z: 10 21.766 2.204 0.698 0.862 1.000 0.889 CA 1.423 10 residues pruned to eliminate duplicates Z: 18 37.434 2.574 0.397 0.911 1.000 0.824 CA 1.789 18 residues pruned to eliminate duplicates Z: 35 43.922 2.501 0.568 0.703 0.971 0.765 CA 1.645 35 residues pruned to eliminate duplicates Z: 14 26.826 2.081 1.055 0.820 0.846 0.692 CA 1.558 14 residues pruned to eliminate duplicates Z: 27 44.427 2.587 1.172 0.832 0.885 0.692 CA 1.315 27 residues pruned to eliminate duplicates Z: 73 67.527 2.605 0.792 0.531 0.917 0.625 CB 1.804 73 residues pruned to eliminate duplicates Z: 31 15.324 2.152 0.485 0.250 0.833 0.533 CB 1.400 Z: 140 109.233 2.661 0.828 0.614 0.914 0.698 CB 1.871 140 residues pruned to eliminate duplicates Z: 25 49.549 2.631 0.619 0.905 0.958 0.875 CA 1.763 25 residues pruned to eliminate duplicates Z: 12 18.920 2.117 0.408 0.859 0.909 0.727 CB 1.549 12 residues pruned to eliminate duplicates Z: 12 5.728 2.166 0.242 0.224 0.909 0.545 CB 0.976 12 residues pruned to eliminate duplicates Z: 11 4.674 1.781 0.713 0.382 0.600 0.300 CB 0.916 Z: 39 40.192 2.518 0.540 0.629 0.895 0.632 CA 1.664 39 residues pruned to eliminate duplicates Z: 12 29.788 2.400 0.929 0.882 0.909 0.727 CA 1.544 12 residues pruned to eliminate duplicates Z: 61 42.483 2.370 0.585 0.446 0.933 0.600 CB 1.653 61 residues pruned to eliminate duplicates Z: 10 17.183 1.969 0.650 0.748 0.889 0.556 N 1.589 10 residues pruned to eliminate duplicates Z: 63 58.588 2.629 0.751 0.596 0.887 0.677 CA 1.663 63 residues pruned to eliminate duplicates Z: 56 55.887 2.533 0.641 0.656 0.945 0.800 CA 1.659 56 residues pruned to eliminate duplicates Z: 10 8.139 2.194 0.509 0.364 0.778 0.333 CB 1.219 10 residues pruned to eliminate duplicates 6 1.465 2.034 -0.180 0.696 1.000 0.800 CB 0.328 ? Z: 13 13.967 2.095 0.540 0.413 0.833 0.417 N 1.643 24 residues pruned to eliminate duplicates Z: 20 29.244 2.202 0.429 0.883 0.947 0.737 CB 1.628 20 residues pruned to eliminate duplicates Z: 22 24.581 2.133 0.560 0.789 0.857 0.667 CB 1.459 22 residues pruned to eliminate duplicates Z: 20 53.224 2.530 1.053 0.885 0.895 0.368 CB 1.898 20 residues pruned to eliminate duplicates Z: 6 6.023 1.997 0.343 0.482 0.600 0.600 N 1.706 Z: 20 33.662 2.437 0.552 0.868 0.947 0.895 CA 1.575 20 residues pruned to eliminate duplicates Z: 9 26.567 2.228 1.104 0.702 1.000 0.500 CA 1.666 9 residues pruned to eliminate duplicates Z: 61 36.762 2.338 0.461 0.422 0.900 0.667 CB 1.675 61 residues pruned to eliminate duplicates Z: 9 21.130 2.150 0.637 0.833 1.000 0.750 CA 1.593 9 residues pruned to eliminate duplicates Z: 9 3.567 1.599 0.371 0.264 0.750 0.250 N 1.005 Z: 141 97.456 2.660 0.867 0.573 0.879 0.571 CA 1.758 109 residues pruned to eliminate duplicates 6 1.420 1.528 -0.035 0.495 0.600 0.600 CB 0.721 ? Z: 7 10.137 2.044 0.284 0.872 1.000 0.667 CB 1.150 7 residues pruned to eliminate duplicates Z: 97 102.850 2.725 0.984 0.602 0.906 0.562 CB 1.944 97 residues pruned to eliminate duplicates Z: 8 5.561 1.922 0.941 0.241 0.571 0.429 CA 1.331 Z: 21 31.312 2.229 0.584 0.860 0.950 0.800 CB 1.535 21 residues pruned to eliminate duplicates Z: 11 8.181 2.066 0.239 0.434 0.800 0.500 CA 1.353 11 residues pruned to eliminate duplicates Z: 22 24.776 2.149 0.381 0.865 0.952 0.810 CB 1.402 22 residues pruned to eliminate duplicates 7 1.552 1.531 -0.246 0.462 0.833 0.500 N 0.684 ? 6 1.660 1.672 -0.193 0.299 0.600 0.400 N 1.147 ? Z: 143 75.754 2.512 0.641 0.501 0.908 0.585 CB 1.697 143 residues pruned to eliminate duplicates Z: 24 68.946 2.710 1.282 0.935 0.957 0.522 CA 1.693 24 residues pruned to eliminate duplicates Z: 6 6.919 2.104 0.351 0.496 0.800 0.600 O 1.366 Z: 10 30.002 2.155 1.122 0.861 1.000 0.667 CA 1.607 10 residues pruned to eliminate duplicates Z: 6 3.650 2.073 0.424 0.451 0.800 0.400 CB 0.727 Z: 19 31.950 2.403 0.603 0.897 1.000 0.833 CA 1.399 19 residues pruned to eliminate duplicates Z: 18 33.946 2.101 1.029 0.863 1.000 0.471 CB 1.417 18 residues pruned to eliminate duplicates Z: 16 24.201 1.959 0.759 0.917 1.000 0.733 CA 1.279 16 residues pruned to eliminate duplicates Z: 21 29.167 2.380 0.217 0.842 0.950 0.750 CB 1.766 21 residues pruned to eliminate duplicates Z: 28 37.253 2.547 0.965 0.484 0.889 0.519 CB 1.637 28 residues pruned to eliminate duplicates Z: 140 82.681 2.516 0.671 0.541 0.892 0.669 CB 1.795 140 residues pruned to eliminate duplicates Z: 8 7.759 1.738 0.674 0.753 1.000 0.857 CA 0.805 8 residues pruned to eliminate duplicates Z: 79 49.285 2.460 0.570 0.462 0.936 0.513 CB 1.604 39 residues pruned to eliminate duplicates Z: 15 35.167 2.849 0.624 0.926 1.000 0.929 CA 1.424 15 residues pruned to eliminate duplicates Z: 62 33.986 2.380 0.401 0.488 0.885 0.656 CB 1.492 62 residues pruned to eliminate duplicates Z: 21 29.416 2.145 0.581 0.884 0.950 0.850 CB 1.475 21 residues pruned to eliminate duplicates Z: 21 40.486 2.132 1.044 0.882 1.000 0.800 CA 1.504 21 residues pruned to eliminate duplicates Z: 19 34.213 2.251 0.817 0.874 1.000 0.667 CA 1.435 19 residues pruned to eliminate duplicates Z: 8 6.609 2.208 0.658 0.519 0.714 0.571 CB 0.938 10 residues pruned to eliminate duplicates Z: 22 42.942 2.163 1.152 0.909 1.000 0.524 CB 1.428 21 residues pruned to eliminate duplicates Z: 44 29.340 2.319 0.419 0.410 0.907 0.581 CB 1.647 44 residues pruned to eliminate duplicates Z: 14 10.947 2.301 0.575 0.241 0.846 0.462 CB 1.336 14 residues pruned to eliminate duplicates Z: 7 3.648 1.899 0.268 0.359 1.000 0.500 CB 0.720 Z: 9 14.005 2.394 1.081 0.663 0.750 0.375 CA 1.140 9 residues pruned to eliminate duplicates Z: 9 30.619 2.327 0.981 0.909 1.000 0.625 N 1.666 9 residues pruned to eliminate duplicates Z: 8 5.784 2.066 0.439 0.418 0.714 0.571 CB 1.122 Z: 30 55.785 2.444 1.234 0.740 0.931 0.586 CA 1.643 25 residues pruned to eliminate duplicates Z: 8 14.234 2.106 0.434 0.793 0.857 0.286 N 1.607 8 residues pruned to eliminate duplicates Z: 22 40.128 2.141 0.961 0.893 1.000 0.571 CB 1.497 22 residues pruned to eliminate duplicates Z: 22 44.827 2.243 1.082 0.883 0.952 0.571 CA 1.590 22 residues pruned to eliminate duplicates Z: 20 33.818 2.205 0.541 0.886 1.000 0.737 CA 1.649 20 residues pruned to eliminate duplicates Z: 7 2.855 1.990 -0.374 0.509 0.833 0.333 CB 1.114 Z: 21 29.890 2.321 0.524 0.884 1.000 0.900 CA 1.365 21 residues pruned to eliminate duplicates Z: 34 22.830 2.316 0.673 0.490 0.697 0.515 CB 1.486 34 residues pruned to eliminate duplicates Z: 36 64.117 2.577 1.249 0.761 0.943 0.657 CA 1.572 36 residues pruned to eliminate duplicates Z: 13 17.383 2.464 0.270 0.529 0.917 0.667 CB 1.700 Z: 11 9.834 2.172 0.260 0.447 1.000 0.700 CA 1.200 11 residues pruned to eliminate duplicates Z: 20 37.938 2.497 0.645 0.872 1.000 0.842 CA 1.545 20 residues pruned to eliminate duplicates Z: 27 66.438 2.560 1.418 0.827 0.923 0.423 CA 1.718 27 residues pruned to eliminate duplicates Z: 10 14.706 2.233 0.643 0.846 0.889 0.667 CB 1.118 10 residues pruned to eliminate duplicates Z: 12 17.100 2.078 0.264 0.873 1.000 0.818 CB 1.430 12 residues pruned to eliminate duplicates Z: 90 62.578 2.497 0.670 0.461 0.955 0.640 CB 1.734 90 residues pruned to eliminate duplicates Z: 19 39.559 2.474 0.527 0.895 1.000 0.778 CA 1.769 19 residues pruned to eliminate duplicates Z: 19 30.970 2.306 0.317 0.883 1.000 0.833 CA 1.738 19 residues pruned to eliminate duplicates Z: 44 26.496 2.080 0.598 0.509 0.814 0.465 CB 1.480 44 residues pruned to eliminate duplicates 6 1.794 1.471 0.325 0.609 0.600 0.600 CA 0.618 ? Z: 31 24.890 2.155 0.585 0.527 0.867 0.600 CB 1.495 29 residues pruned to eliminate duplicates Z: 23 22.986 2.406 0.355 0.447 0.864 0.500 CB 1.838 13 residues pruned to eliminate duplicates Z: 11 17.196 1.945 0.746 0.890 1.000 0.700 CA 1.152 10 residues pruned to eliminate duplicates Z: 8 15.296 2.253 0.534 0.457 1.000 0.571 CB 1.748 8 residues pruned to eliminate duplicates Z: 32 26.262 2.275 0.509 0.564 0.903 0.613 CB 1.429 32 residues pruned to eliminate duplicates Z: 10 19.237 2.052 0.731 0.927 1.000 0.889 CA 1.264 11 residues pruned to eliminate duplicates Z: 8 8.063 1.873 0.183 0.720 1.000 0.857 CA 1.127 8 residues pruned to eliminate duplicates Z: 66 41.147 2.415 0.548 0.437 0.908 0.523 CB 1.605 66 residues pruned to eliminate duplicates Z: 40 54.442 2.694 0.795 0.590 0.872 0.641 CA 1.897 40 residues pruned to eliminate duplicates Z: 17 20.583 2.043 0.775 0.902 0.938 0.812 CB 1.080 17 residues pruned to eliminate duplicates Z: 83 58.721 2.484 0.581 0.580 0.902 0.683 CA 1.693 83 residues pruned to eliminate duplicates Z: 20 38.794 2.472 0.713 0.841 0.947 0.789 CA 1.655 20 residues pruned to eliminate duplicates Z: 7 6.417 1.983 0.410 0.668 0.833 0.667 CB 0.962 Z: 19 22.343 1.990 0.973 0.852 0.944 0.667 CA 1.051 19 residues pruned to eliminate duplicates Z: 19 34.101 2.321 0.449 0.872 1.000 0.833 CA 1.742 19 residues pruned to eliminate duplicates Z: 11 12.235 2.296 0.390 0.371 0.900 0.500 CA 1.548 11 residues pruned to eliminate duplicates Z: 6 3.462 1.844 0.401 0.299 0.600 0.400 CB 1.250 Z: 8 12.618 2.152 0.296 0.722 1.000 0.857 CB 1.399 Z: 13 14.767 1.922 0.136 0.860 1.000 0.833 CB 1.435 13 residues pruned to eliminate duplicates Z: 18 41.675 2.525 0.629 0.894 1.000 0.882 CB 1.763 18 residues pruned to eliminate duplicates Z: 173 75.981 2.464 0.560 0.488 0.907 0.622 CB 1.683 173 residues pruned to eliminate duplicates Z: 69 59.647 2.523 0.630 0.526 0.926 0.647 CB 1.850 69 residues pruned to eliminate duplicates Z: 9 15.395 2.258 0.614 0.827 1.000 0.625 CB 1.125 Z: 9 22.457 2.190 1.005 0.624 1.000 0.750 CB 1.609 9 residues pruned to eliminate duplicates Z: 9 11.941 2.127 0.331 0.722 0.875 0.750 CB 1.395 9 residues pruned to eliminate duplicates Z: 6 4.889 1.816 0.370 0.553 0.600 0.600 CB 1.391 Z: 6 10.593 1.688 0.701 0.800 1.000 0.400 CA 1.269 6 residues pruned to eliminate duplicates Z: 6 4.336 1.945 0.549 0.469 0.800 0.400 CB 0.830 Z: 22 29.824 2.123 0.436 0.934 1.000 1.000 CA 1.489 22 residues pruned to eliminate duplicates Z: 6 4.480 1.702 0.836 0.489 0.600 0.600 CA 1.081 Z: 59 51.967 2.515 0.709 0.483 0.931 0.569 CB 1.734 182 residues pruned to eliminate duplicates Z: 17 23.237 2.108 0.358 0.883 1.000 0.875 CB 1.467 17 residues pruned to eliminate duplicates Z: 6 4.693 1.808 0.479 0.477 0.800 0.400 CA 1.004 Z: 7 11.659 2.125 0.623 0.839 1.000 0.833 CB 1.030 7 residues pruned to eliminate duplicates Z: 20 46.570 2.367 0.940 0.892 1.000 0.579 CB 1.671 20 residues pruned to eliminate duplicates Z: 8 20.764 2.274 1.308 0.780 0.857 0.714 CB 1.363 8 residues pruned to eliminate duplicates Z: 6 4.115 1.631 0.955 0.452 0.600 0.600 CB 1.011 Z: 28 58.107 2.741 1.212 0.818 0.926 0.444 CA 1.512 28 residues pruned to eliminate duplicates Z: 19 59.517 2.735 0.905 0.939 0.944 0.500 CB 1.981 19 residues pruned to eliminate duplicates Z: 8 26.647 2.461 1.518 0.848 0.857 0.857 CA 1.407 8 residues pruned to eliminate duplicates Z: 9 15.841 2.110 0.469 0.838 0.875 0.500 CB 1.543 Z: 8 19.113 2.215 0.508 0.795 1.000 0.857 CB 1.670 9 residues pruned to eliminate duplicates Z: 49 48.292 2.442 0.692 0.516 0.896 0.667 CB 1.854 Z: 19 45.130 2.330 0.886 0.902 0.944 0.222 CA 1.829 19 residues pruned to eliminate duplicates Z: 10 15.583 1.925 0.570 0.738 1.000 0.333 CA 1.388 8 residues pruned to eliminate duplicates Z: 113 64.237 2.400 0.736 0.555 0.884 0.554 CB 1.563 113 residues pruned to eliminate duplicates Z: 131 72.619 2.545 0.558 0.495 0.923 0.631 CB 1.750 131 residues pruned to eliminate duplicates Z: 20 34.388 2.401 0.552 0.886 1.000 0.789 CA 1.527 20 residues pruned to eliminate duplicates Z: 20 25.254 2.370 0.668 0.497 0.947 0.421 CB 1.551 15 residues pruned to eliminate duplicates Z: 93 63.614 2.504 0.587 0.503 0.924 0.620 CB 1.802 64 residues pruned to eliminate duplicates Z: 13 28.557 2.175 0.825 0.843 0.917 0.583 CB 1.687 13 residues pruned to eliminate duplicates Z: 49 84.879 2.752 1.042 0.739 0.979 0.729 CA 1.797 49 residues pruned to eliminate duplicates Z: 22 25.600 2.418 0.872 0.560 0.810 0.667 CA 1.438 21 residues pruned to eliminate duplicates Z: 96 79.877 2.653 0.626 0.556 0.947 0.684 CB 1.899 96 residues pruned to eliminate duplicates Z: 10 4.784 1.561 0.372 0.340 0.778 0.667 CB 1.139 Z: 18 11.643 2.194 0.375 0.294 1.000 0.529 CB 1.179 18 residues pruned to eliminate duplicates Z: 20 33.706 2.083 0.936 0.897 0.947 0.789 CB 1.449 20 residues pruned to eliminate duplicates Z: 18 20.494 2.095 0.607 0.764 0.824 0.588 CB 1.418 18 residues pruned to eliminate duplicates Z: 8 16.740 2.159 0.246 0.840 1.000 0.714 CA 1.756 8 residues pruned to eliminate duplicates Z: 6 3.124 1.702 0.699 0.620 0.600 0.400 CB 0.719 Z: 19 60.805 2.693 1.466 0.890 0.889 0.722 CA 1.747 19 residues pruned to eliminate duplicates Z: 18 30.568 2.214 0.889 0.925 1.000 0.588 CB 1.243 18 residues pruned to eliminate duplicates Z: 66 92.974 2.748 1.197 0.649 0.923 0.523 CA 1.802 66 residues pruned to eliminate duplicates Z: 27 32.555 2.452 0.909 0.457 0.923 0.615 CB 1.544 27 residues pruned to eliminate duplicates Z: 52 35.297 2.415 0.495 0.471 0.902 0.588 CB 1.563 52 residues pruned to eliminate duplicates Z: 10 18.491 2.173 0.783 0.799 0.889 0.556 CA 1.378 10 residues pruned to eliminate duplicates Z: 12 21.234 2.125 0.436 0.846 1.000 0.909 N 1.558 12 residues pruned to eliminate duplicates Z: 19 12.817 2.003 0.690 0.280 0.889 0.500 CB 1.287 14 residues pruned to eliminate duplicates Z: 21 43.523 2.288 1.003 0.911 1.000 0.800 CB 1.506 21 residues pruned to eliminate duplicates Z: 18 25.657 2.123 0.883 0.886 0.941 0.588 CB 1.193 18 residues pruned to eliminate duplicates Z: 20 35.612 2.175 0.662 0.896 1.000 0.789 CA 1.619 20 residues pruned to eliminate duplicates Z: 17 20.414 2.136 0.219 0.884 1.000 0.750 CB 1.416 17 residues pruned to eliminate duplicates Z: 19 38.181 2.537 0.492 0.892 1.000 0.889 CA 1.708 19 residues pruned to eliminate duplicates Z: 18 34.600 2.193 1.146 0.918 0.941 0.353 CA 1.337 20 residues pruned to eliminate duplicates Z: 6 2.146 1.561 0.063 0.482 0.600 0.400 N 0.981 Z: 9 8.402 1.952 0.483 0.515 0.875 0.750 CB 1.155 7 residues pruned to eliminate duplicates Z: 9 14.388 2.093 0.821 0.726 0.875 0.625 CB 1.244 9 residues pruned to eliminate duplicates Z: 217 114.848 2.565 0.755 0.575 0.926 0.579 CB 1.744 217 residues pruned to eliminate duplicates Z: 6 6.754 1.683 0.747 0.649 1.000 0.800 CA 0.894 6 residues pruned to eliminate duplicates Z: 19 34.512 2.556 0.394 0.897 1.000 0.889 CA 1.633 19 residues pruned to eliminate duplicates Z: 20 10.956 2.017 0.278 0.386 0.895 0.421 CB 1.230 Z: 21 24.288 1.917 0.541 0.903 0.950 0.900 CA 1.380 Z: 21 10.296 2.060 0.355 0.247 0.800 0.400 CB 1.379 20 residues pruned to eliminate duplicates Z: 46 34.272 2.283 0.487 0.541 0.889 0.689 CB 1.625 46 residues pruned to eliminate duplicates Z: 67 54.465 2.501 0.599 0.533 0.939 0.606 CB 1.728 67 residues pruned to eliminate duplicates Z: 13 18.538 1.998 0.555 0.892 0.917 0.750 CB 1.350 13 residues pruned to eliminate duplicates Z: 10 5.331 2.045 0.053 0.402 1.000 0.444 CB 0.914 10 residues pruned to eliminate duplicates Z: 19 30.968 2.144 0.795 0.887 0.944 0.556 CB 1.448 19 residues pruned to eliminate duplicates Z: 63 62.692 2.560 0.827 0.596 0.935 0.661 CB 1.660 63 residues pruned to eliminate duplicates Z: 12 19.655 2.045 0.519 0.759 0.909 0.545 CB 1.667 11 residues pruned to eliminate duplicates Z: 19 23.361 2.043 0.529 0.875 0.944 0.833 CB 1.357 19 residues pruned to eliminate duplicates Z: 19 36.935 2.096 1.409 0.931 1.000 0.833 CA 1.205 18 residues pruned to eliminate duplicates Z: 25 34.558 2.696 0.477 0.933 0.958 0.833 CA 1.290 25 residues pruned to eliminate duplicates Z: 19 33.067 2.197 0.877 0.930 0.944 0.833 CB 1.400 19 residues pruned to eliminate duplicates Z: 31 29.038 2.274 0.615 0.565 0.867 0.733 CB 1.564 31 residues pruned to eliminate duplicates Z: 66 40.998 2.353 0.531 0.428 0.938 0.662 CB 1.620 66 residues pruned to eliminate duplicates Z: 42 39.098 2.243 0.847 0.509 0.854 0.585 CB 1.710 42 residues pruned to eliminate duplicates Z: 53 46.452 2.533 0.608 0.465 0.923 0.654 CB 1.775 53 residues pruned to eliminate duplicates Z: 9 15.772 2.436 0.731 0.791 0.750 0.625 CB 1.366 9 residues pruned to eliminate duplicates Z: 19 26.369 2.221 0.408 0.895 0.944 0.833 CA 1.509 19 residues pruned to eliminate duplicates Z: 26 61.532 2.524 1.250 0.868 0.960 0.440 CA 1.650 26 residues pruned to eliminate duplicates Z: 17 20.678 2.135 0.181 0.913 1.000 0.812 CB 1.451 17 residues pruned to eliminate duplicates Z: 13 10.099 1.911 0.265 0.396 0.917 0.667 CB 1.468 11 residues pruned to eliminate duplicates Z: 11 15.084 1.886 0.517 0.695 0.900 0.400 N 1.550 11 residues pruned to eliminate duplicates Z: 11 27.991 2.400 0.411 0.913 1.000 0.900 CA 1.850 11 residues pruned to eliminate duplicates Z: 124 76.681 2.431 0.697 0.623 0.919 0.667 CB 1.626 124 residues pruned to eliminate duplicates Z: 101 50.709 2.406 0.550 0.449 0.880 0.610 CB 1.628 103 residues pruned to eliminate duplicates Z: 152 101.134 2.606 0.821 0.594 0.894 0.662 CB 1.773 152 residues pruned to eliminate duplicates Z: 24 16.123 2.108 0.416 0.363 0.913 0.565 CB 1.430 24 residues pruned to eliminate duplicates Z: 12 12.590 2.371 0.315 0.536 0.818 0.636 CB 1.436 12 residues pruned to eliminate duplicates Z: 50 34.821 2.192 0.616 0.504 0.898 0.612 CB 1.557 50 residues pruned to eliminate duplicates Z: 12 16.649 1.979 0.181 0.910 1.000 0.909 CB 1.523 12 residues pruned to eliminate duplicates Z: 30 41.486 2.647 0.653 0.570 0.931 0.517 CB 1.768 30 residues pruned to eliminate duplicates Z: 8 5.950 1.840 0.617 0.454 0.714 0.571 N 1.109 Z: 10 15.971 2.039 0.363 0.872 1.000 0.556 N 1.395 10 residues pruned to eliminate duplicates Z: 19 30.486 2.067 0.840 0.855 1.000 0.667 CB 1.395 19 residues pruned to eliminate duplicates Z: 13 8.249 1.888 0.628 0.478 0.833 0.583 CB 0.950 6 residues pruned to eliminate duplicates Z: 9 16.359 2.017 0.881 0.872 0.875 0.750 CA 1.270 9 residues pruned to eliminate duplicates Z: 13 26.585 2.203 0.626 0.882 1.000 0.750 CA 1.551 13 residues pruned to eliminate duplicates Z: 12 14.750 2.137 0.266 0.791 0.818 0.545 N 1.556 12 residues pruned to eliminate duplicates Z: 26 51.679 2.728 1.181 0.731 0.920 0.680 CA 1.533 26 residues pruned to eliminate duplicates Z: 6 4.200 1.917 0.652 0.299 0.800 0.600 N 0.929 Z: 25 22.937 2.148 0.532 0.650 0.875 0.667 CB 1.414 25 residues pruned to eliminate duplicates Z: 10 14.988 2.029 0.719 0.823 0.889 0.778 CA 1.218 10 residues pruned to eliminate duplicates Z: 19 32.803 2.083 0.718 0.864 0.944 0.778 CA 1.677 19 residues pruned to eliminate duplicates Z: 17 28.880 2.507 1.105 0.533 0.812 0.625 CA 1.630 17 residues pruned to eliminate duplicates Z: 26 60.108 2.471 1.321 0.909 0.920 0.280 CB 1.617 26 residues pruned to eliminate duplicates Z: 7 13.462 2.146 0.780 0.700 0.833 0.833 CA 1.439 Z: 24 58.109 2.633 1.040 0.909 0.957 0.565 CA 1.673 24 residues pruned to eliminate duplicates Z: 16 22.112 2.469 0.557 0.487 1.000 0.600 CB 1.505 16 residues pruned to eliminate duplicates Z: 246 116.119 2.568 0.728 0.536 0.918 0.620 CB 1.756 246 residues pruned to eliminate duplicates Z: 25 33.342 2.745 0.564 0.893 0.917 0.833 CA 1.242 25 residues pruned to eliminate duplicates Z: 22 41.906 2.191 1.091 0.906 0.952 0.810 CB 1.491 21 residues pruned to eliminate duplicates Z: 31 22.692 2.176 0.555 0.556 0.867 0.500 CB 1.337 32 residues pruned to eliminate duplicates Z: 10 5.833 2.018 0.722 0.333 0.556 0.444 CB 1.209 9 residues pruned to eliminate duplicates Z: 25 38.666 2.509 0.757 0.863 0.958 0.750 CA 1.371 25 residues pruned to eliminate duplicates 6 1.827 1.675 0.340 0.402 0.600 0.600 CB 0.673 ? Z: 14 9.166 2.176 0.370 0.289 0.923 0.462 CB 1.171 14 residues pruned to eliminate duplicates Z: 56 72.552 2.696 0.845 0.671 0.927 0.655 CA 1.811 56 residues pruned to eliminate duplicates Z: 38 22.470 2.238 0.406 0.452 0.919 0.595 CB 1.342 38 residues pruned to eliminate duplicates Z: 7 8.302 1.752 0.566 0.842 0.833 0.833 CB 1.104 7 residues pruned to eliminate duplicates Z: 7 3.586 1.421 0.783 0.246 0.667 0.500 CB 1.161 Z: 19 15.930 2.199 0.538 0.275 0.889 0.556 CB 1.612 19 residues pruned to eliminate duplicates Z: 19 35.064 2.476 0.576 0.897 1.000 0.611 CA 1.517 19 residues pruned to eliminate duplicates Z: 72 58.602 2.491 0.912 0.548 0.901 0.592 CB 1.547 72 residues pruned to eliminate duplicates Z: 20 49.232 2.515 0.995 0.886 1.000 0.895 CA 1.624 20 residues pruned to eliminate duplicates Z: 20 35.885 2.451 0.726 0.836 0.947 0.684 CA 1.537 20 residues pruned to eliminate duplicates Z: 12 34.897 2.376 1.032 0.859 0.909 0.818 CA 1.763 12 residues pruned to eliminate duplicates Z: 29 14.621 1.969 0.417 0.421 0.964 0.571 CB 1.115 19 residues pruned to eliminate duplicates Z: 6 5.821 1.900 0.292 0.767 1.000 0.600 CB 0.837 Z: 21 22.141 2.094 0.275 0.861 0.950 0.950 CB 1.434 21 residues pruned to eliminate duplicates Z: 118 98.564 2.625 0.947 0.610 0.923 0.598 CA 1.741 118 residues pruned to eliminate duplicates Z: 6 2.101 1.710 0.489 0.533 0.600 0.400 CB 0.595 Z: 44 33.721 2.466 0.760 0.519 0.744 0.209 CB 1.562 44 residues pruned to eliminate duplicates Z: 19 29.889 2.198 0.457 0.877 0.944 0.778 CB 1.693 19 residues pruned to eliminate duplicates Z: 71 76.814 2.683 1.047 0.554 0.871 0.571 CA 1.820 71 residues pruned to eliminate duplicates Z: 17 34.940 2.163 1.425 0.921 0.875 0.500 CA 1.339 18 residues pruned to eliminate duplicates Z: 13 23.258 2.356 0.762 0.763 0.917 0.583 CA 1.397 13 residues pruned to eliminate duplicates Z: 99 56.034 2.367 0.666 0.457 0.898 0.612 CA 1.670 99 residues pruned to eliminate duplicates Z: 20 28.520 2.098 0.928 0.914 1.000 0.632 CB 1.143 20 residues pruned to eliminate duplicates Z: 17 13.953 2.211 0.503 0.388 0.938 0.625 CB 1.260 13 residues pruned to eliminate duplicates Z: 18 30.702 2.302 0.404 0.891 1.000 0.882 CA 1.657 18 residues pruned to eliminate duplicates Z: 32 34.592 2.447 1.216 0.395 0.806 0.484 CB 1.588 32 residues pruned to eliminate duplicates Z: 30 33.877 2.320 0.681 0.523 0.966 0.552 CB 1.633 30 residues pruned to eliminate duplicates Z: 7 16.160 2.354 0.235 0.858 1.000 0.833 CA 1.671 7 residues pruned to eliminate duplicates 6 1.723 1.405 0.327 0.434 0.600 0.400 C 0.737 ? Z: 9 14.537 2.064 1.113 0.557 0.750 0.625 CB 1.486 Z: 13 21.663 1.902 0.556 0.921 1.000 0.833 CA 1.487 13 residues pruned to eliminate duplicates Z: 12 17.847 2.133 0.769 0.525 0.909 0.545 CB 1.530 Z: 7 4.876 1.991 0.293 0.360 0.833 0.500 CB 1.078 Z: 8 2.518 1.290 0.306 0.299 0.714 0.571 O 0.990 Z: 14 16.706 2.444 0.459 0.440 0.923 0.385 CB 1.498 14 residues pruned to eliminate duplicates Z: 58 45.126 2.390 0.740 0.530 0.860 0.632 CB 1.623 59 residues pruned to eliminate duplicates Z: 12 16.040 2.112 0.393 0.859 0.909 0.545 CB 1.331 12 residues pruned to eliminate duplicates Z: 97 75.411 2.545 0.725 0.563 0.927 0.656 CB 1.779 97 residues pruned to eliminate duplicates Z: 6 2.444 1.857 -0.152 0.370 0.600 0.400 CB 1.329 6 residues pruned to eliminate duplicates Z: 65 89.392 2.775 1.004 0.654 0.922 0.547 CB 1.888 65 residues pruned to eliminate duplicates Z: 20 41.794 2.409 0.804 0.891 0.947 0.842 CA 1.674 20 residues pruned to eliminate duplicates Z: 13 18.848 1.823 0.461 0.886 1.000 0.750 CA 1.474 13 residues pruned to eliminate duplicates Z: 33 34.434 2.210 0.887 0.704 0.938 0.469 CB 1.294 34 residues pruned to eliminate duplicates Z: 41 36.980 2.334 0.702 0.460 0.950 0.600 CB 1.614 41 residues pruned to eliminate duplicates Z: 83 49.365 2.433 0.536 0.451 0.890 0.585 CB 1.723 83 residues pruned to eliminate duplicates Z: 9 15.972 2.079 0.718 0.791 0.875 0.625 CA 1.400 9 residues pruned to eliminate duplicates Z: 20 35.697 2.353 0.510 0.896 1.000 0.789 CA 1.652 20 residues pruned to eliminate duplicates Z: 12 7.832 2.012 0.997 0.325 0.818 0.364 CB 0.871 Z: 28 14.146 2.026 0.437 0.338 0.852 0.519 CB 1.309 29 residues pruned to eliminate duplicates Z: 8 5.529 2.091 -0.083 0.522 1.000 0.429 CB 1.067 7 residues pruned to eliminate duplicates Z: 22 56.268 2.672 1.062 0.931 0.952 0.762 CA 1.635 22 residues pruned to eliminate duplicates Z: 63 58.567 2.513 0.886 0.590 0.903 0.677 CB 1.594 63 residues pruned to eliminate duplicates Z: 35 23.457 2.209 0.381 0.522 0.882 0.559 CA 1.462 35 residues pruned to eliminate duplicates Z: 22 34.011 2.090 0.682 0.922 1.000 0.952 CA 1.484 22 residues pruned to eliminate duplicates Z: 6 4.284 1.883 0.503 0.577 0.600 0.400 CA 1.047 6 residues pruned to eliminate duplicates Z: 6 2.786 1.805 0.225 0.303 0.800 0.400 CA 0.877 Z: 6 6.319 1.777 0.720 0.732 1.000 0.600 CA 0.750 Z: 9 32.720 2.462 0.833 0.889 1.000 0.500 CB 1.846 9 residues pruned to eliminate duplicates Z: 18 5.057 1.844 0.614 0.283 0.588 0.294 CB 0.896 18 residues pruned to eliminate duplicates Z: 9 3.579 1.590 0.662 0.290 0.625 0.625 CB 0.969 Z: 14 8.772 1.959 0.375 0.270 0.923 0.385 CB 1.271 14 residues pruned to eliminate duplicates Z: 6 7.515 1.955 0.429 0.705 0.800 0.600 CB 1.248 Z: 31 33.024 2.518 0.532 0.488 0.967 0.667 CB 1.637 31 residues pruned to eliminate duplicates Z: 63 49.347 2.517 0.599 0.473 0.935 0.532 CB 1.711 63 residues pruned to eliminate duplicates Z: 26 46.857 2.493 0.824 0.892 1.000 0.640 CA 1.480 26 residues pruned to eliminate duplicates Z: 137 90.274 2.560 0.725 0.572 0.919 0.647 CB 1.779 137 residues pruned to eliminate duplicates Z: 20 58.224 2.832 1.049 0.878 0.895 0.579 CA 1.868 20 residues pruned to eliminate duplicates Z: 32 24.783 2.449 0.678 0.426 0.774 0.484 CB 1.511 32 residues pruned to eliminate duplicates Z: 19 37.702 2.451 0.624 0.862 1.000 0.778 CA 1.639 19 residues pruned to eliminate duplicates Z: 144 85.811 2.549 0.735 0.511 0.909 0.524 CB 1.765 164 residues pruned to eliminate duplicates Z: 31 66.915 2.705 1.161 0.747 0.867 0.400 CB 1.934 31 residues pruned to eliminate duplicates Z: 18 31.852 2.299 0.532 0.883 0.882 0.824 CA 1.797 18 residues pruned to eliminate duplicates Z: 8 19.538 2.463 0.685 0.832 0.857 0.571 N 1.558 8 residues pruned to eliminate duplicates Z: 6 8.260 1.892 0.995 0.471 0.600 0.400 N 1.680 Z: 18 13.543 2.301 0.260 0.481 0.882 0.529 CB 1.310 18 residues pruned to eliminate duplicates Z: 66 48.414 2.554 0.564 0.467 0.923 0.662 CB 1.684 66 residues pruned to eliminate duplicates Z: 20 26.852 2.085 0.585 0.858 1.000 0.737 CB 1.373 20 residues pruned to eliminate duplicates Z: 17 25.453 2.141 0.610 0.930 1.000 0.938 CB 1.291 17 residues pruned to eliminate duplicates Z: 13 6.205 1.989 0.263 0.295 0.750 0.667 CB 1.196 Z: 23 15.178 2.193 0.612 0.279 0.864 0.500 CB 1.361 23 residues pruned to eliminate duplicates Z: 6 8.252 1.777 0.533 0.667 1.000 0.800 CB 1.160 Z: 14 23.873 2.429 0.677 0.863 1.000 0.923 CA 1.193 14 residues pruned to eliminate duplicates Z: 20 35.241 2.172 0.735 0.877 0.947 0.737 CB 1.644 20 residues pruned to eliminate duplicates Z: 10 9.034 2.145 0.363 0.227 0.889 0.222 CB 1.594 10 residues pruned to eliminate duplicates Z: 208 119.985 2.615 0.773 0.587 0.918 0.589 CB 1.803 208 residues pruned to eliminate duplicates Z: 6 11.177 1.899 1.290 0.765 1.000 0.600 N 0.909 6 residues pruned to eliminate duplicates Z: 9 9.520 1.915 0.467 0.790 0.875 0.875 CB 1.062 9 residues pruned to eliminate duplicates Z: 21 8.062 2.029 0.628 0.264 0.600 0.400 CB 1.191 8 residues pruned to eliminate duplicates Z: 7 3.101 1.532 0.379 0.358 0.667 0.500 CB 1.048 Z: 46 31.750 2.195 0.494 0.553 0.933 0.578 CB 1.468 46 residues pruned to eliminate duplicates Z: 10 13.067 1.968 0.647 0.531 0.778 0.778 CB 1.676 9 1.934 1.570 0.143 0.548 0.750 0.625 CB 0.484 ? Z: 20 21.792 2.479 0.483 0.348 1.000 0.737 CB 1.603 20 residues pruned to eliminate duplicates Z: 13 23.225 1.941 0.716 0.900 1.000 0.833 CA 1.438 13 residues pruned to eliminate duplicates Z: 6 7.436 2.168 1.099 0.594 1.000 0.600 CB 0.668 Z: 12 14.256 2.369 0.408 0.373 0.909 0.727 CB 1.624 12 residues pruned to eliminate duplicates Z: 92 53.682 2.428 0.561 0.482 0.879 0.560 CB 1.719 89 residues pruned to eliminate duplicates Z: 8 5.103 1.778 0.378 0.681 1.000 0.714 CB 0.667 6 residues pruned to eliminate duplicates Z: 19 77.562 2.807 1.313 0.904 0.944 0.556 CA 2.123 Z: 26 29.609 2.579 0.665 0.604 0.840 0.640 CA 1.488 26 residues pruned to eliminate duplicates Z: 38 33.372 2.446 0.742 0.443 0.865 0.622 CB 1.579 38 residues pruned to eliminate duplicates Z: 9 3.104 1.653 0.386 0.236 0.875 0.625 CB 0.744 Z: 33 28.466 2.226 0.569 0.610 0.875 0.719 CB 1.483 33 residues pruned to eliminate duplicates Z: 19 35.046 2.396 0.732 0.839 0.944 0.833 CA 1.574 19 residues pruned to eliminate duplicates Z: 19 17.244 2.229 0.479 0.537 0.833 0.722 CA 1.427 19 residues pruned to eliminate duplicates Z: 84 77.936 2.677 0.653 0.559 0.916 0.651 CB 1.994 84 residues pruned to eliminate duplicates Z: 32 27.700 2.160 0.569 0.649 0.806 0.484 CB 1.584 39 residues pruned to eliminate duplicates Z: 13 13.309 2.407 0.324 0.267 1.000 0.417 CB 1.572 13 residues pruned to eliminate duplicates Z: 84 45.110 2.437 0.492 0.408 0.904 0.627 CB 1.659 115 residues pruned to eliminate duplicates Z: 42 28.724 2.189 0.551 0.521 0.805 0.610 CB 1.608 42 residues pruned to eliminate duplicates Z: 18 38.120 2.292 0.909 0.912 1.000 0.824 CB 1.497 18 residues pruned to eliminate duplicates Z: 6 8.843 1.934 1.053 0.745 0.800 0.600 CA 1.000 6 residues pruned to eliminate duplicates Z: 27 22.237 2.334 0.560 0.363 0.885 0.654 CB 1.570 27 residues pruned to eliminate duplicates Z: 110 77.062 2.614 0.613 0.546 0.917 0.606 CB 1.823 110 residues pruned to eliminate duplicates Z: 13 27.543 2.107 0.626 0.902 1.000 0.750 CB 1.655 13 residues pruned to eliminate duplicates Z: 12 19.465 2.315 0.834 0.541 0.909 0.545 CB 1.460 Z: 123 71.890 2.550 0.537 0.517 0.910 0.598 CB 1.794 123 residues pruned to eliminate duplicates Z: 17 32.897 2.356 0.504 0.918 1.000 0.625 CB 1.637 17 residues pruned to eliminate duplicates Z: 6 7.149 1.663 0.342 0.849 0.800 0.800 O 1.328 Z: 12 17.188 1.942 0.736 0.892 0.909 0.636 CA 1.215 12 residues pruned to eliminate duplicates Z: 33 29.156 2.485 0.481 0.471 0.875 0.625 CB 1.648 33 residues pruned to eliminate duplicates Z: 18 33.350 2.337 0.748 0.920 0.941 0.824 CA 1.482 18 residues pruned to eliminate duplicates Z: 9 2.522 2.027 0.317 0.229 0.625 0.375 CB 0.733 7 residues pruned to eliminate duplicates Z: 6 12.145 1.825 0.693 0.820 1.000 0.800 CA 1.332 7 residues pruned to eliminate duplicates Z: 7 4.722 1.239 1.405 0.604 0.833 0.500 N 0.704 Z: 24 76.066 2.738 1.386 0.926 0.957 0.565 CA 1.781 24 residues pruned to eliminate duplicates Z: 14 14.845 2.186 0.477 0.418 0.923 0.692 CA 1.505 13 residues pruned to eliminate duplicates Z: 124 87.269 2.609 0.779 0.560 0.878 0.634 CA 1.821 124 residues pruned to eliminate duplicates Z: 18 46.207 2.456 0.991 0.923 0.941 0.529 CB 1.711 18 residues pruned to eliminate duplicates Z: 13 25.268 1.962 0.776 0.908 1.000 0.583 N 1.487 13 residues pruned to eliminate duplicates Z: 6 4.010 1.489 0.394 0.592 0.800 0.600 CB 0.989 Z: 46 39.016 2.417 0.619 0.538 0.911 0.667 CB 1.572 46 residues pruned to eliminate duplicates Z: 76 71.062 2.527 0.903 0.627 0.907 0.600 CB 1.670 76 residues pruned to eliminate duplicates Z: 11 23.331 2.265 0.369 0.881 1.000 0.700 CA 1.723 11 residues pruned to eliminate duplicates Z: 32 32.970 2.526 0.585 0.494 0.871 0.613 CB 1.707 32 residues pruned to eliminate duplicates Z: 19 31.552 2.199 0.731 0.859 0.944 0.833 CA 1.522 19 residues pruned to eliminate duplicates Z: 9 16.076 2.128 0.757 0.832 1.000 0.875 CA 1.141 9 residues pruned to eliminate duplicates Z: 67 41.615 2.413 0.608 0.447 0.909 0.652 CB 1.533 67 residues pruned to eliminate duplicates Z: 73 50.195 2.518 0.565 0.493 0.917 0.625 CB 1.648 73 residues pruned to eliminate duplicates Z: 96 66.065 2.473 0.810 0.574 0.874 0.579 CB 1.614 96 residues pruned to eliminate duplicates Z: 73 47.623 2.437 0.704 0.464 0.861 0.514 CB 1.628 73 residues pruned to eliminate duplicates Z: 15 15.404 2.437 0.413 0.453 0.929 0.571 CB 1.351 15 residues pruned to eliminate duplicates Z: 53 64.234 2.521 1.032 0.683 0.904 0.654 CB 1.627 53 residues pruned to eliminate duplicates Z: 39 60.584 2.463 1.173 0.686 0.921 0.526 CA 1.681 39 residues pruned to eliminate duplicates Z: 8 6.754 1.510 1.679 0.297 0.714 0.429 CB 1.109 Z: 12 11.937 2.115 0.304 0.408 1.000 0.545 CB 1.437 12 residues pruned to eliminate duplicates Z: 57 45.431 2.475 0.558 0.517 0.893 0.643 CB 1.735 57 residues pruned to eliminate duplicates Z: 36 69.130 2.564 1.140 0.806 0.914 0.457 CB 1.783 36 residues pruned to eliminate duplicates Z: 9 14.036 2.149 0.284 0.853 1.000 0.875 CB 1.329 9 residues pruned to eliminate duplicates Z: 28 32.196 2.430 0.435 0.599 0.926 0.778 CA 1.745 28 residues pruned to eliminate duplicates Z: 24 17.234 2.144 0.541 0.400 0.783 0.565 CB 1.545 24 residues pruned to eliminate duplicates Z: 6 14.914 2.380 0.917 0.593 1.000 0.600 CB 1.338 Z: 27 45.113 2.504 0.703 0.876 0.962 0.769 CA 1.568 27 residues pruned to eliminate duplicates Z: 30 38.630 2.485 0.549 0.703 0.897 0.828 CA 1.728 30 residues pruned to eliminate duplicates Z: 216 112.236 2.576 0.756 0.535 0.926 0.605 CB 1.767 216 residues pruned to eliminate duplicates Z: 43 38.697 2.513 0.611 0.461 0.929 0.548 CB 1.652 43 residues pruned to eliminate duplicates Z: 9 8.896 1.887 0.643 0.478 0.750 0.625 CB 1.384 9 residues pruned to eliminate duplicates Z: 10 7.368 2.051 0.618 0.364 0.778 0.667 CB 1.101 Z: 11 13.316 2.201 0.327 0.598 1.000 0.700 CB 1.313 11 residues pruned to eliminate duplicates Z: 79 51.619 2.498 0.604 0.530 0.872 0.641 CB 1.624 79 residues pruned to eliminate duplicates Z: 33 18.751 2.165 0.401 0.476 0.812 0.469 CB 1.378 33 residues pruned to eliminate duplicates Z: 18 30.419 2.158 0.724 0.925 1.000 0.941 CB 1.391 19 residues pruned to eliminate duplicates Z: 65 67.056 2.562 0.945 0.646 0.859 0.516 CA 1.708 65 residues pruned to eliminate duplicates Z: 8 14.162 2.196 0.156 0.844 1.000 1.000 CA 1.569 8 residues pruned to eliminate duplicates Z: 26 19.186 2.276 0.528 0.370 0.760 0.400 CB 1.669 26 residues pruned to eliminate duplicates Z: 6 7.340 1.921 -0.037 0.776 1.000 0.600 N 1.390 6 residues pruned to eliminate duplicates Z: 21 29.062 2.113 0.822 0.856 0.950 0.850 CA 1.311 21 residues pruned to eliminate duplicates Z: 18 27.437 2.291 0.554 0.915 0.941 0.706 CA 1.404 18 residues pruned to eliminate duplicates Z: 58 49.862 2.432 0.586 0.559 0.930 0.614 CB 1.739 70 residues pruned to eliminate duplicates Z: 42 35.636 2.270 0.623 0.501 0.951 0.634 CB 1.587 42 residues pruned to eliminate duplicates Z: 26 53.918 2.489 1.251 0.744 0.880 0.280 CB 1.758 26 residues pruned to eliminate duplicates Z: 47 63.963 2.619 1.096 0.640 0.804 0.609 CA 1.874 47 residues pruned to eliminate duplicates Z: 6 11.712 1.899 0.889 0.660 1.000 0.400 CB 1.259 6 residues pruned to eliminate duplicates Z: 19 23.572 2.533 0.666 0.493 0.833 0.556 CB 1.590 28 residues pruned to eliminate duplicates Z: 10 8.325 2.266 0.335 0.342 0.667 0.444 CA 1.635 10 residues pruned to eliminate duplicates Z: 41 15.281 2.111 0.388 0.225 0.850 0.475 CB 1.339 35 residues pruned to eliminate duplicates Z: 62 51.875 2.482 0.735 0.533 0.918 0.623 CB 1.626 62 residues pruned to eliminate duplicates Z: 9 12.377 1.967 0.610 0.674 0.875 0.750 CB 1.346 10 residues pruned to eliminate duplicates Z: 16 8.634 1.993 0.362 0.384 0.667 0.533 CB 1.393 17 residues pruned to eliminate duplicates Z: 7 9.365 2.069 0.471 0.628 0.833 0.500 CA 1.336 7 residues pruned to eliminate duplicates Z: 168 110.898 2.636 0.851 0.575 0.940 0.557 CA 1.740 168 residues pruned to eliminate duplicates Z: 16 20.216 2.411 0.474 0.481 0.800 0.600 CA 1.872 16 residues pruned to eliminate duplicates Z: 20 27.361 2.277 0.533 0.914 0.947 0.789 CA 1.342 20 residues pruned to eliminate duplicates Z: 120 87.990 2.610 0.791 0.581 0.882 0.580 CB 1.809 120 residues pruned to eliminate duplicates Z: 10 15.828 1.953 0.437 0.859 0.889 0.889 CA 1.556 10 residues pruned to eliminate duplicates Z: 7 7.629 1.460 1.157 0.703 0.833 0.667 CB 0.986 7 residues pruned to eliminate duplicates Z: 73 46.569 2.467 0.546 0.461 0.903 0.639 CB 1.658 73 residues pruned to eliminate duplicates Z: 26 20.827 2.209 0.417 0.441 0.880 0.480 CB 1.607 66 residues pruned to eliminate duplicates Z: 6 3.020 1.837 0.009 0.224 0.800 0.600 CB 1.259 Z: 6 8.635 1.665 0.599 0.811 1.000 0.600 CB 1.107 Z: 19 24.754 2.107 0.611 0.892 1.000 0.833 CB 1.235 18 residues pruned to eliminate duplicates Z: 15 8.012 2.003 0.489 0.354 0.571 0.286 CB 1.472 15 residues pruned to eliminate duplicates Z: 65 50.831 2.559 0.648 0.481 0.891 0.578 CA 1.725 65 residues pruned to eliminate duplicates Z: 34 34.607 2.444 0.882 0.517 0.788 0.364 CB 1.635 34 residues pruned to eliminate duplicates Z: 20 26.072 2.339 0.456 0.895 1.000 0.895 CA 1.259 20 residues pruned to eliminate duplicates Z: 63 62.575 2.433 1.028 0.655 0.903 0.500 CB 1.544 63 residues pruned to eliminate duplicates Z: 19 29.609 2.277 0.729 0.899 0.944 0.889 CA 1.342 19 residues pruned to eliminate duplicates Z: 13 11.370 1.795 0.736 0.518 0.833 0.333 N 1.242 7 residues pruned to eliminate duplicates Z: 12 16.641 1.679 0.726 0.820 1.000 0.636 CA 1.312 12 residues pruned to eliminate duplicates Z: 33 57.069 2.467 1.172 0.722 0.906 0.469 CA 1.700 33 residues pruned to eliminate duplicates Z: 23 17.481 2.178 0.149 0.552 0.818 0.409 CB 1.730 23 residues pruned to eliminate duplicates Z: 33 40.287 2.552 0.917 0.437 0.844 0.562 CB 1.841 33 residues pruned to eliminate duplicates Z: 15 21.377 1.854 0.981 0.739 0.929 0.643 CA 1.352 15 residues pruned to eliminate duplicates Z: 71 54.427 2.470 0.644 0.544 0.943 0.600 CB 1.627 55 residues pruned to eliminate duplicates Z: 18 30.576 2.463 0.391 0.870 1.000 0.706 CA 1.581 18 residues pruned to eliminate duplicates Z: 149 96.351 2.594 0.765 0.592 0.885 0.622 CB 1.788 149 residues pruned to eliminate duplicates Z: 101 57.896 2.500 0.640 0.447 0.930 0.570 CB 1.602 108 residues pruned to eliminate duplicates Z: 20 38.293 2.111 1.064 0.897 1.000 0.632 CB 1.443 20 residues pruned to eliminate duplicates Z: 8 13.717 2.299 0.208 0.680 0.857 0.714 CB 1.845 8 residues pruned to eliminate duplicates Z: 9 19.349 2.137 0.585 0.784 1.000 0.750 CB 1.572 9 residues pruned to eliminate duplicates Z: 30 39.711 2.497 0.640 0.582 0.931 0.552 CA 1.788 30 residues pruned to eliminate duplicates Z: 17 14.235 2.305 0.390 0.388 0.750 0.500 CB 1.667 17 residues pruned to eliminate duplicates Z: 7 3.635 1.941 0.312 0.228 0.667 0.500 CB 1.200 5 residues pruned to eliminate duplicates Z: 9 13.115 2.049 0.129 0.874 1.000 1.000 CB 1.459 9 residues pruned to eliminate duplicates Z: 14 19.976 2.841 0.517 0.903 1.000 0.846 CA 0.916 14 residues pruned to eliminate duplicates 6 0.463 1.380 0.653 0.467 0.800 0.600 CB 0.117 ? 6 0.846 1.922 0.883 0.802 0.800 0.600 CB 0.100 ? Z: 137 75.702 2.469 0.603 0.547 0.926 0.669 CB 1.691 137 residues pruned to eliminate duplicates Z: 28 30.732 2.293 0.774 0.579 0.926 0.630 CA 1.455 31 residues pruned to eliminate duplicates Z: 21 44.794 2.354 0.901 0.917 1.000 0.900 CA 1.579 21 residues pruned to eliminate duplicates Z: 7 7.869 1.695 0.791 0.410 0.833 0.500 O 1.396 Z: 10 3.221 1.682 0.070 0.474 0.778 0.444 CB 0.787 Z: 14 20.072 2.206 0.584 0.775 0.846 0.615 CB 1.476 14 residues pruned to eliminate duplicates Z: 32 33.530 2.296 0.556 0.571 0.935 0.710 CB 1.683 32 residues pruned to eliminate duplicates Z: 60 27.877 2.348 0.397 0.382 0.864 0.508 CB 1.451 60 residues pruned to eliminate duplicates Z: 22 12.179 1.960 0.400 0.277 0.952 0.619 CB 1.308 Z: 91 62.228 2.543 0.602 0.453 0.944 0.578 CB 1.790 96 residues pruned to eliminate duplicates Z: 15 26.200 2.070 1.059 0.914 0.929 0.571 CA 1.251 Z: 127 66.911 2.528 0.491 0.496 0.913 0.611 CB 1.740 127 residues pruned to eliminate duplicates Z: 19 31.621 2.299 0.337 0.884 1.000 0.889 CA 1.752 19 residues pruned to eliminate duplicates Z: 21 13.408 1.979 0.316 0.596 0.850 0.650 CB 1.235 21 residues pruned to eliminate duplicates Z: 12 3.110 1.611 0.147 0.174 0.636 0.364 C 1.183 Z: 8 11.145 2.098 0.531 0.613 0.714 0.714 CA 1.649 8 residues pruned to eliminate duplicates Z: 10 13.861 2.030 0.578 0.784 1.000 0.667 CB 1.123 Z: 61 43.394 2.365 0.572 0.458 0.967 0.633 CB 1.627 58 residues pruned to eliminate duplicates Z: 8 11.384 1.856 0.931 0.644 0.857 0.429 CB 1.225 Z: 43 50.719 2.460 0.914 0.653 0.857 0.357 CB 1.682 43 residues pruned to eliminate duplicates 6 1.216 1.212 0.459 0.273 0.600 0.400 N 0.663 ? 6 1.129 1.260 1.242 0.496 0.400 0.400 C 0.448 ? Z: 52 36.593 2.335 0.513 0.446 0.922 0.647 CB 1.663 52 residues pruned to eliminate duplicates Z: 6 6.556 2.029 0.686 0.706 1.000 0.800 CB 0.710 Z: 20 47.849 2.392 1.146 0.903 0.895 0.737 CB 1.704 20 residues pruned to eliminate duplicates Z: 20 41.246 2.464 0.833 0.874 1.000 0.789 CA 1.525 20 residues pruned to eliminate duplicates Z: 29 32.046 2.285 0.831 0.847 0.929 0.786 CA 1.157 39 residues pruned to eliminate duplicates Z: 25 30.867 2.510 0.946 0.419 0.833 0.500 CB 1.685 25 residues pruned to eliminate duplicates Z: 9 18.683 2.312 0.828 0.782 1.000 0.625 CA 1.219 9 residues pruned to eliminate duplicates Z: 7 11.484 2.269 0.374 0.412 1.000 1.000 CA 1.649 7 residues pruned to eliminate duplicates Z: 7 4.813 1.793 0.668 0.375 0.667 0.500 CB 1.125 Z: 6 2.128 1.827 0.176 0.100 0.600 0.400 CA 1.231 6 residues pruned to eliminate duplicates Z: 55 77.539 2.691 0.951 0.661 0.907 0.537 CB 1.909 55 residues pruned to eliminate duplicates Z: 15 6.288 1.810 0.708 0.201 0.786 0.286 CB 0.987 8 residues pruned to eliminate duplicates Z: 20 47.746 2.611 0.898 0.920 0.842 0.632 CA 1.848 20 residues pruned to eliminate duplicates Z: 9 6.961 2.082 0.175 0.289 0.750 0.500 CA 1.701 Z: 19 52.797 2.605 1.037 0.929 0.889 0.444 CA 1.847 19 residues pruned to eliminate duplicates Z: 24 12.088 2.062 0.273 0.357 0.826 0.522 CB 1.356 Z: 18 13.912 2.106 0.487 0.314 0.941 0.529 CB 1.405 18 residues pruned to eliminate duplicates Z: 6 4.396 1.766 0.607 0.538 0.800 0.600 CB 0.835 6 residues pruned to eliminate duplicates Z: 8 8.241 1.915 0.499 0.446 0.857 0.714 CA 1.339 Z: 136 96.700 2.591 0.892 0.595 0.874 0.600 CB 1.774 136 residues pruned to eliminate duplicates Z: 21 43.052 2.173 1.026 0.913 1.000 0.900 CB 1.547 21 residues pruned to eliminate duplicates Z: 6 9.749 1.720 1.187 0.753 1.000 0.600 C 0.925 Z: 19 16.693 2.042 0.159 0.859 0.944 0.889 CB 1.295 19 residues pruned to eliminate duplicates Z: 10 12.826 1.738 0.678 0.816 1.000 0.778 CA 1.114 10 residues pruned to eliminate duplicates Z: 19 16.901 2.199 0.538 0.420 0.944 0.667 CB 1.356 20 residues pruned to eliminate duplicates Z: 20 14.370 2.004 0.478 0.435 0.947 0.579 CB 1.257 20 residues pruned to eliminate duplicates Z: 15 14.397 2.288 0.785 0.432 0.786 0.571 CB 1.287 13 residues pruned to eliminate duplicates Z: 55 44.918 2.455 0.542 0.482 0.926 0.648 CB 1.775 55 residues pruned to eliminate duplicates 10 1.945 1.441 0.819 0.220 0.444 0.444 CB 0.773 ? Z: 19 14.663 2.271 0.437 0.434 0.778 0.556 CB 1.457 19 residues pruned to eliminate duplicates Z: 94 72.713 2.502 0.840 0.593 0.849 0.387 CA 1.763 136 residues pruned to eliminate duplicates Z: 39 30.119 2.244 0.517 0.531 0.868 0.658 CB 1.603 39 residues pruned to eliminate duplicates Z: 22 24.145 2.128 0.322 0.897 1.000 0.905 CB 1.341 22 residues pruned to eliminate duplicates Z: 6 3.098 1.808 0.247 0.372 0.800 0.600 CB 0.881 Z: 24 14.144 1.887 0.561 0.374 0.870 0.652 CB 1.318 25 residues pruned to eliminate duplicates Z: 6 5.046 2.038 0.548 0.635 0.600 0.400 CA 1.050 6 residues pruned to eliminate duplicates Z: 47 42.938 2.430 0.530 0.541 0.935 0.652 CB 1.750 47 residues pruned to eliminate duplicates Z: 6 2.688 1.417 0.588 0.343 0.600 0.400 N 1.057 Z: 7 9.073 1.682 0.433 0.717 1.000 0.500 O 1.263 Z: 21 43.077 2.495 0.635 0.831 1.000 0.800 CA 1.774 21 residues pruned to eliminate duplicates Z: 18 27.991 2.087 1.002 0.909 0.941 0.588 CA 1.225 15 residues pruned to eliminate duplicates Z: 7 3.257 1.978 1.269 0.806 0.833 0.667 CB 0.272 Z: 64 42.697 2.437 0.566 0.444 0.952 0.603 CB 1.567 64 residues pruned to eliminate duplicates Z: 12 26.212 2.189 0.428 0.895 1.000 0.818 CA 1.813 12 residues pruned to eliminate duplicates Z: 8 24.226 2.641 0.788 0.886 0.857 0.571 CA 1.633 8 residues pruned to eliminate duplicates Z: 23 15.594 2.182 0.610 0.350 0.909 0.500 CB 1.224 23 residues pruned to eliminate duplicates Z: 6 9.153 1.941 0.727 0.480 0.800 0.600 N 1.558 Z: 66 41.601 2.434 0.513 0.463 0.908 0.646 CB 1.602 66 residues pruned to eliminate duplicates Z: 61 55.987 2.473 0.725 0.630 0.900 0.717 CB 1.667 61 residues pruned to eliminate duplicates Z: 21 20.625 2.423 0.627 0.432 0.850 0.650 CB 1.477 21 residues pruned to eliminate duplicates Z: 74 33.730 2.256 0.546 0.391 0.863 0.548 CB 1.473 74 residues pruned to eliminate duplicates Z: 6 5.464 1.933 0.194 0.429 1.000 0.400 CB 1.139 Z: 12 5.770 1.652 0.685 0.312 0.818 0.636 CB 0.940 Z: 11 20.571 2.144 0.378 0.916 1.000 0.900 CB 1.555 11 residues pruned to eliminate duplicates Z: 40 42.079 2.541 0.719 0.467 0.872 0.590 CA 1.830 40 residues pruned to eliminate duplicates Z: 14 14.092 2.434 0.694 0.460 0.769 0.538 CA 1.284 14 residues pruned to eliminate duplicates Z: 19 35.288 2.365 1.011 0.903 0.944 0.778 CA 1.320 19 residues pruned to eliminate duplicates Z: 9 4.450 1.550 0.700 0.253 0.875 0.500 CB 0.907 Z: 11 11.173 1.918 0.425 0.537 0.900 0.700 CB 1.386 10 residues pruned to eliminate duplicates Z: 12 26.828 2.180 0.548 0.877 1.000 0.818 CA 1.741 12 residues pruned to eliminate duplicates Z: 10 21.384 2.310 0.638 0.826 1.000 0.778 CA 1.421 10 residues pruned to eliminate duplicates Z: 17 37.467 2.547 0.659 0.926 0.938 0.688 CA 1.658 17 residues pruned to eliminate duplicates Z: 12 16.500 2.104 0.522 0.794 0.909 0.636 CB 1.322 12 residues pruned to eliminate duplicates Z: 8 20.748 2.370 0.934 0.876 0.857 0.571 CB 1.451 8 residues pruned to eliminate duplicates Z: 13 17.498 1.988 0.985 0.766 0.750 0.333 CA 1.348 13 residues pruned to eliminate duplicates Z: 6 6.374 2.071 0.592 0.443 0.800 0.800 CB 1.146 5 residues pruned to eliminate duplicates Z: 54 53.940 2.428 0.789 0.613 0.887 0.660 CA 1.729 61 residues pruned to eliminate duplicates Z: 7 21.652 2.273 0.865 0.851 1.000 1.000 CA 1.543 7 residues pruned to eliminate duplicates Z: 19 11.709 2.145 0.434 0.265 0.889 0.333 CB 1.319 21 residues pruned to eliminate duplicates Z: 8 5.650 2.179 0.193 0.340 0.714 0.286 CB 1.369 Z: 64 53.596 2.436 0.727 0.595 0.889 0.651 CA 1.649 64 residues pruned to eliminate duplicates Z: 25 29.388 2.455 0.847 0.444 0.875 0.625 CA 1.602 25 residues pruned to eliminate duplicates Z: 6 4.281 1.760 0.152 0.856 1.000 1.000 CB 0.696 Z: 18 26.922 2.151 0.698 0.920 0.941 0.765 CA 1.337 18 residues pruned to eliminate duplicates Z: 21 64.057 2.622 1.408 0.881 0.950 0.600 CA 1.729 21 residues pruned to eliminate duplicates Z: 46 38.192 2.500 0.450 0.526 0.867 0.622 CB 1.766 46 residues pruned to eliminate duplicates Z: 17 31.243 1.847 1.535 0.918 1.000 0.500 CB 1.177 16 residues pruned to eliminate duplicates Z: 6 5.273 1.658 1.021 0.379 0.600 0.600 N 1.335 Z: 6 4.517 1.712 0.553 0.557 0.600 0.600 CB 1.198 6 residues pruned to eliminate duplicates Z: 6 4.921 2.289 -0.036 0.197 1.000 0.400 CB 1.431 6 residues pruned to eliminate duplicates Z: 48 39.804 2.340 0.688 0.476 0.894 0.617 CB 1.685 48 residues pruned to eliminate duplicates Z: 54 41.126 2.389 0.598 0.565 0.849 0.585 CB 1.636 54 residues pruned to eliminate duplicates Z: 13 19.524 2.011 0.423 0.832 1.000 0.667 CB 1.479 13 residues pruned to eliminate duplicates Z: 15 13.653 2.447 0.180 0.438 1.000 0.500 CB 1.347 15 residues pruned to eliminate duplicates Z: 90 61.482 2.468 0.621 0.571 0.899 0.708 CA 1.693 90 residues pruned to eliminate duplicates Z: 16 12.283 1.851 0.535 0.417 0.867 0.533 CB 1.404 16 residues pruned to eliminate duplicates Z: 9 5.260 1.567 1.080 0.488 0.875 0.500 N 0.660 Z: 23 9.354 2.028 0.264 0.323 0.773 0.364 CB 1.223 23 residues pruned to eliminate duplicates Z: 23 32.425 2.091 0.660 0.891 0.955 0.909 CA 1.499 23 residues pruned to eliminate duplicates Z: 16 27.619 2.204 0.527 0.855 1.000 0.933 CA 1.564 16 residues pruned to eliminate duplicates Z: 12 18.788 1.862 0.668 0.804 1.000 0.727 CA 1.400 12 residues pruned to eliminate duplicates Z: 7 2.975 1.550 0.131 0.362 0.667 0.667 CB 1.205 5 residues pruned to eliminate duplicates Z: 52 77.513 2.742 1.123 0.696 0.902 0.549 CA 1.728 52 residues pruned to eliminate duplicates Z: 27 33.585 2.377 0.739 0.474 0.962 0.615 CB 1.701 27 residues pruned to eliminate duplicates Z: 6 6.779 1.837 0.567 0.800 0.800 0.400 CA 1.013 Z: 19 17.036 2.067 0.537 0.511 0.778 0.611 N 1.607 19 residues pruned to eliminate duplicates Z: 6 2.731 1.305 0.596 0.402 0.800 0.400 N 0.812 Z: 6 3.088 1.744 0.096 0.548 0.800 0.600 CB 0.862 Z: 91 57.750 2.419 0.672 0.513 0.922 0.656 CB 1.611 91 residues pruned to eliminate duplicates Z: 15 9.234 2.109 0.465 0.367 0.857 0.571 CB 1.074 6 residues pruned to eliminate duplicates Z: 11 16.551 2.351 0.419 0.518 1.000 0.600 CA 1.541 11 residues pruned to eliminate duplicates Z: 13 12.981 1.924 0.274 0.840 0.917 0.750 CB 1.244 13 residues pruned to eliminate duplicates Z: 21 31.262 2.490 0.771 0.585 0.850 0.600 CB 1.719 21 residues pruned to eliminate duplicates Z: 26 38.071 2.204 0.930 0.690 0.920 0.720 CA 1.636 26 residues pruned to eliminate duplicates Z: 6 2.757 1.552 0.932 0.480 0.600 0.600 CA 0.699 6 residues pruned to eliminate duplicates Z: 6 8.252 1.754 1.273 0.645 0.600 0.600 O 1.348 6 residues pruned to eliminate duplicates Z: 14 19.636 2.122 0.573 0.792 0.923 0.615 CB 1.368 14 residues pruned to eliminate duplicates Z: 18 29.999 2.153 1.002 0.944 1.000 0.824 CA 1.169 18 residues pruned to eliminate duplicates Z: 15 19.586 2.084 0.576 0.750 1.000 0.643 CA 1.275 15 residues pruned to eliminate duplicates Z: 194 115.749 2.542 0.864 0.590 0.907 0.668 CA 1.779 194 residues pruned to eliminate duplicates Z: 12 17.340 2.076 0.650 0.692 0.909 0.545 CA 1.409 12 residues pruned to eliminate duplicates Z: 22 38.080 2.208 0.697 0.899 1.000 0.762 CB 1.586 22 residues pruned to eliminate duplicates Z: 71 44.495 2.369 0.647 0.525 0.900 0.614 CB 1.478 71 residues pruned to eliminate duplicates Z: 13 14.635 2.326 0.212 0.532 0.917 0.500 CB 1.585 Z: 19 33.849 2.279 0.528 0.867 1.000 0.722 CA 1.676 Z: 16 41.542 2.608 0.893 0.941 0.933 0.800 CA 1.616 16 residues pruned to eliminate duplicates Z: 68 42.041 2.493 0.470 0.448 0.881 0.507 CB 1.680 68 residues pruned to eliminate duplicates Z: 7 5.284 2.037 -0.126 0.769 1.000 0.833 CB 0.955 7 residues pruned to eliminate duplicates Z: 11 21.667 2.148 0.506 0.926 1.000 0.900 CB 1.485 11 residues pruned to eliminate duplicates Z: 7 3.784 2.074 -0.052 0.253 0.667 0.500 CB 1.566 Z: 20 31.098 2.199 0.379 0.884 1.000 0.947 CA 1.700 20 residues pruned to eliminate duplicates Z: 25 82.940 2.799 1.333 0.911 0.917 0.667 CB 2.004 25 residues pruned to eliminate duplicates Z: 17 18.107 2.093 0.145 0.906 1.000 0.938 CB 1.344 17 residues pruned to eliminate duplicates Z: 19 39.862 2.281 0.871 0.927 1.000 0.944 CA 1.543 19 residues pruned to eliminate duplicates Z: 14 8.003 1.957 0.400 0.392 0.769 0.462 CB 1.181 Z: 20 30.951 2.592 0.554 0.663 0.947 0.737 CB 1.599 20 residues pruned to eliminate duplicates Z: 9 4.813 1.732 0.715 0.265 0.875 0.625 CB 0.856 Z: 11 18.746 1.964 0.681 0.868 1.000 0.700 N 1.313 11 residues pruned to eliminate duplicates Z: 25 32.339 2.382 0.523 0.874 0.958 0.917 CA 1.382 25 residues pruned to eliminate duplicates Z: 26 54.268 2.481 1.184 0.803 0.920 0.440 CA 1.671 26 residues pruned to eliminate duplicates Z: 20 30.627 2.414 0.457 0.913 1.000 0.947 CA 1.414 20 residues pruned to eliminate duplicates Z: 17 13.385 2.074 0.609 0.423 0.812 0.375 CB 1.337 17 residues pruned to eliminate duplicates Z: 6 6.484 1.813 0.487 0.857 1.000 0.800 CA 0.793 6 residues pruned to eliminate duplicates Z: 24 9.620 1.706 0.387 0.283 0.826 0.261 CB 1.311 Z: 20 14.507 2.137 0.588 0.305 0.947 0.526 CB 1.286 20 residues pruned to eliminate duplicates Z: 37 29.290 2.373 0.712 0.411 0.861 0.556 CB 1.532 37 residues pruned to eliminate duplicates Z: 18 9.056 1.984 0.266 0.273 0.941 0.529 CB 1.201 18 residues pruned to eliminate duplicates Z: 6 4.155 1.603 0.547 0.664 0.600 0.200 O 1.073 Z: 6 2.010 1.879 0.116 0.469 0.800 0.400 CB 0.553 Z: 9 6.305 2.207 0.394 0.594 0.875 0.625 CB 0.757 9 residues pruned to eliminate duplicates Z: 17 22.473 1.988 1.165 0.889 0.875 0.500 CA 1.074 17 residues pruned to eliminate duplicates Z: 14 7.080 2.036 0.363 0.291 0.846 0.308 CB 1.057 14 residues pruned to eliminate duplicates Z: 6 9.096 2.411 0.794 0.390 0.800 0.600 CB 1.321 6 residues pruned to eliminate duplicates Z: 20 24.442 2.240 0.627 0.580 0.895 0.579 CA 1.592 20 residues pruned to eliminate duplicates Z: 136 104.696 2.582 0.901 0.624 0.941 0.570 CB 1.735 136 residues pruned to eliminate duplicates Z: 55 40.220 2.466 0.704 0.449 0.759 0.444 CB 1.808 55 residues pruned to eliminate duplicates Z: 11 3.966 1.882 0.246 0.224 0.700 0.600 CB 1.056 Z: 70 61.643 2.524 0.901 0.563 0.870 0.565 CB 1.673 70 residues pruned to eliminate duplicates 6 0.962 2.108 -0.053 0.260 0.200 0.000 CB 1.419 ? Z: 6 8.255 1.901 0.744 0.825 1.000 0.800 CA 0.840 6 residues pruned to eliminate duplicates Z: 10 15.820 2.005 0.410 0.872 1.000 0.556 CA 1.359 10 residues pruned to eliminate duplicates Z: 12 6.592 1.825 0.349 0.363 0.818 0.545 N 1.144 9 residues pruned to eliminate duplicates Z: 92 68.268 2.473 0.856 0.596 0.868 0.505 CB 1.638 92 residues pruned to eliminate duplicates Z: 92 66.438 2.527 0.600 0.568 0.890 0.714 CB 1.812 92 residues pruned to eliminate duplicates Z: 10 6.127 1.622 0.286 0.382 0.889 0.222 CB 1.248 Z: 14 9.688 2.156 0.136 0.467 0.769 0.231 CB 1.476 14 residues pruned to eliminate duplicates Z: 32 21.262 2.074 0.487 0.470 0.935 0.645 CB 1.365 32 residues pruned to eliminate duplicates Z: 6 4.916 1.572 0.967 0.739 0.800 0.400 CB 0.717 Z: 6 3.919 2.405 -0.210 0.787 1.000 0.800 CB 0.717 6 residues pruned to eliminate duplicates Z: 12 15.671 2.258 0.585 0.810 0.909 0.636 CA 1.108 12 residues pruned to eliminate duplicates Z: 19 26.803 2.226 0.386 0.876 1.000 0.944 CA 1.488 19 residues pruned to eliminate duplicates Z: 79 42.094 2.279 0.570 0.416 0.910 0.577 CB 1.598 79 residues pruned to eliminate duplicates Z: 6 5.160 1.715 0.743 0.656 0.800 0.800 O 0.835 Z: 8 4.364 1.529 0.353 0.257 1.000 0.571 O 1.053 Z: 64 59.496 2.716 0.523 0.545 0.905 0.667 CA 1.916 64 residues pruned to eliminate duplicates Z: 16 26.112 1.947 1.250 0.877 0.933 0.600 CA 1.198 16 residues pruned to eliminate duplicates Z: 10 8.503 2.197 0.473 0.660 0.889 0.889 CB 0.849 9 residues pruned to eliminate duplicates Z: 16 4.913 2.035 0.451 0.280 0.600 0.200 CB 0.918 Z: 26 70.909 2.686 1.257 0.894 0.920 0.520 CA 1.825 26 residues pruned to eliminate duplicates Z: 14 27.432 2.116 0.664 0.861 1.000 0.692 CA 1.587 14 residues pruned to eliminate duplicates Z: 99 56.810 2.407 0.720 0.448 0.908 0.592 CB 1.610 99 residues pruned to eliminate duplicates Z: 52 54.992 2.704 0.571 0.568 0.922 0.667 CA 1.843 52 residues pruned to eliminate duplicates Z: 79 48.041 2.472 0.631 0.421 0.936 0.667 CB 1.565 79 residues pruned to eliminate duplicates Z: 10 12.868 2.195 0.334 0.587 0.889 0.444 CB 1.515 10 residues pruned to eliminate duplicates Z: 7 4.944 1.373 0.707 0.745 0.833 0.500 N 0.830 7 residues pruned to eliminate duplicates Z: 7 2.535 1.435 0.765 0.213 0.500 0.167 CB 1.146 5 residues pruned to eliminate duplicates Z: 22 25.901 2.045 0.794 0.866 1.000 0.762 CB 1.128 22 residues pruned to eliminate duplicates 6 1.333 1.492 0.124 0.300 0.600 0.400 CA 0.742 ? Z: 67 47.732 2.419 0.702 0.445 0.939 0.515 CB 1.608 67 residues pruned to eliminate duplicates Z: 19 58.573 2.649 1.158 0.872 1.000 0.722 CA 1.761 19 residues pruned to eliminate duplicates Z: 18 22.062 2.261 0.890 0.413 0.882 0.529 CB 1.555 18 residues pruned to eliminate duplicates Z: 6 5.092 1.630 0.577 0.816 1.000 0.800 N 0.673 6 residues pruned to eliminate duplicates Z: 21 40.811 2.176 0.949 0.925 1.000 0.900 CB 1.510 27 residues pruned to eliminate duplicates Z: 59 54.849 2.450 0.894 0.547 0.897 0.586 CB 1.653 53 residues pruned to eliminate duplicates Z: 7 5.451 1.763 0.547 0.248 0.833 0.667 CA 1.308 7 residues pruned to eliminate duplicates Z: 16 26.138 1.966 1.284 0.867 0.867 0.533 CA 1.269 16 residues pruned to eliminate duplicates Z: 6 5.522 1.796 0.351 0.664 0.800 0.400 CB 1.093 2 residues pruned to eliminate duplicates Z: 9 11.867 1.831 0.266 0.874 1.000 0.750 CB 1.317 8 residues pruned to eliminate duplicates Z: 71 57.007 2.428 0.721 0.591 0.886 0.729 CA 1.687 71 residues pruned to eliminate duplicates Z: 13 4.472 1.896 0.578 0.175 0.667 0.250 CB 0.959 13 residues pruned to eliminate duplicates Z: 50 49.034 2.519 0.807 0.473 0.939 0.551 CB 1.685 50 residues pruned to eliminate duplicates Z: 25 46.310 2.522 0.783 0.859 0.917 0.708 CA 1.688 25 residues pruned to eliminate duplicates Z: 43 34.127 2.255 0.517 0.530 0.929 0.595 CB 1.610 43 residues pruned to eliminate duplicates Z: 16 16.916 2.140 0.541 0.501 0.933 0.667 N 1.418 16 residues pruned to eliminate duplicates Z: 49 77.064 2.607 1.086 0.720 0.938 0.396 CA 1.788 49 residues pruned to eliminate duplicates Z: 6 7.444 1.637 0.888 0.796 1.000 0.600 CA 0.831 6 residues pruned to eliminate duplicates Z: 37 66.089 2.590 1.065 0.746 0.917 0.472 CB 1.803 37 residues pruned to eliminate duplicates Z: 8 14.816 2.318 0.305 0.779 1.000 0.857 CB 1.448 9 residues pruned to eliminate duplicates Z: 7 4.581 1.521 0.459 0.523 0.833 0.833 CA 0.989 Z: 13 13.544 2.032 0.656 0.380 0.833 0.583 N 1.585 13 residues pruned to eliminate duplicates Z: 40 15.773 2.166 0.263 0.197 0.872 0.462 CB 1.520 22 residues pruned to eliminate duplicates Z: 7 3.902 1.650 -0.098 0.410 1.000 0.333 O 1.175 Z: 19 29.718 2.104 1.084 0.912 1.000 0.889 CA 1.131 19 residues pruned to eliminate duplicates Z: 9 10.063 1.919 0.572 0.594 0.875 0.625 CB 1.232 9 residues pruned to eliminate duplicates Z: 30 27.849 2.322 0.641 0.535 0.793 0.586 CB 1.655 30 residues pruned to eliminate duplicates Z: 138 101.345 2.542 0.955 0.588 0.905 0.657 CB 1.769 138 residues pruned to eliminate duplicates Z: 21 40.014 2.303 0.847 0.914 1.000 0.900 CA 1.488 21 residues pruned to eliminate duplicates Z: 112 59.484 2.473 0.617 0.436 0.919 0.568 CB 1.642 118 residues pruned to eliminate duplicates Z: 28 32.202 2.034 0.966 0.828 0.815 0.519 CA 1.433 28 residues pruned to eliminate duplicates Z: 10 6.256 1.824 0.900 0.354 0.778 0.556 CB 0.906 Z: 52 36.458 2.321 0.551 0.439 0.922 0.588 CB 1.640 52 residues pruned to eliminate duplicates Z: 9 22.072 2.243 0.961 0.815 1.000 0.750 CA 1.349 Z: 7 6.200 1.732 0.645 0.670 0.833 0.667 CB 0.912 Z: 7 2.680 1.876 0.981 0.243 0.667 0.500 CB 0.595 Z: 9 17.999 1.896 0.952 0.887 1.000 0.875 CB 1.240 9 residues pruned to eliminate duplicates Z: 22 23.273 2.225 0.641 0.503 0.952 0.762 CB 1.457 22 residues pruned to eliminate duplicates Z: 20 64.444 2.735 0.974 0.908 0.947 0.895 CA 2.052 19 residues pruned to eliminate duplicates Z: 7 6.795 1.974 0.540 0.259 0.833 0.333 CA 1.443 Z: 20 29.963 2.354 1.107 0.560 0.895 0.579 CB 1.461 20 residues pruned to eliminate duplicates Z: 22 45.900 2.519 1.168 0.613 0.857 0.429 CB 1.923 22 residues pruned to eliminate duplicates Z: 13 20.243 2.002 0.604 0.773 1.000 0.583 CA 1.430 13 residues pruned to eliminate duplicates Z: 70 48.026 2.522 0.610 0.483 0.884 0.580 CB 1.639 70 residues pruned to eliminate duplicates Z: 10 4.262 1.748 0.226 0.328 0.667 0.444 C 1.200 Z: 22 13.530 2.030 0.317 0.310 0.952 0.476 CB 1.431 22 residues pruned to eliminate duplicates Z: 19 28.113 2.312 0.608 0.870 0.944 0.667 CA 1.377 19 residues pruned to eliminate duplicates Z: 94 49.783 2.260 0.591 0.508 0.914 0.570 CB 1.558 95 residues pruned to eliminate duplicates Z: 21 31.551 2.214 0.675 0.789 0.950 0.800 CA 1.553 21 residues pruned to eliminate duplicates Z: 10 31.590 2.429 1.073 0.857 1.000 0.889 CB 1.541 10 residues pruned to eliminate duplicates Z: 6 6.662 1.642 0.795 0.783 1.000 0.600 N 0.788 6 residues pruned to eliminate duplicates Z: 77 62.312 2.524 0.661 0.525 0.934 0.711 CB 1.780 77 residues pruned to eliminate duplicates Z: 19 50.244 2.521 1.078 0.947 0.944 0.667 CA 1.655 19 residues pruned to eliminate duplicates Z: 7 11.877 2.002 1.030 0.512 1.000 0.667 CA 1.179 16 residues pruned to eliminate duplicates Z: 6 2.885 1.636 0.231 0.388 0.600 0.600 CB 1.202 Z: 32 44.229 2.483 0.967 0.566 0.839 0.484 CB 1.819 32 residues pruned to eliminate duplicates Z: 67 39.478 2.410 0.568 0.440 0.924 0.667 CB 1.480 67 residues pruned to eliminate duplicates Z: 7 9.545 1.902 0.657 0.640 0.667 0.500 N 1.628 7 residues pruned to eliminate duplicates Z: 82 64.616 2.477 0.681 0.612 0.926 0.630 CA 1.675 82 residues pruned to eliminate duplicates Z: 19 21.872 2.071 0.595 0.905 1.000 0.833 CA 1.110 18 residues pruned to eliminate duplicates Z: 24 19.806 2.345 0.313 0.580 0.783 0.609 CB 1.587 24 residues pruned to eliminate duplicates Z: 11 3.680 1.532 0.516 0.234 0.600 0.300 CA 1.138 Z: 91 51.982 2.428 0.559 0.531 0.867 0.656 CB 1.619 97 residues pruned to eliminate duplicates Z: 40 65.440 2.620 1.087 0.710 0.897 0.692 CA 1.765 40 residues pruned to eliminate duplicates Z: 84 51.338 2.448 0.629 0.526 0.880 0.639 CB 1.566 97 residues pruned to eliminate duplicates Z: 8 18.552 2.014 1.134 0.777 1.000 0.714 CA 1.278 8 residues pruned to eliminate duplicates Z: 8 7.647 1.938 0.631 0.480 0.857 0.714 CB 1.089 Z: 90 58.686 2.530 0.643 0.461 0.944 0.607 CB 1.650 90 residues pruned to eliminate duplicates Z: 9 4.695 1.674 0.625 0.417 0.875 0.625 CB 0.760 Z: 12 5.517 1.929 0.850 0.213 0.455 0.455 CA 1.437 Z: 12 21.820 2.156 0.856 0.852 1.000 0.455 CB 1.216 12 residues pruned to eliminate duplicates Z: 97 73.498 2.528 0.692 0.600 0.917 0.583 CB 1.740 97 residues pruned to eliminate duplicates Z: 17 8.460 2.106 0.191 0.198 0.875 0.500 CB 1.381 17 residues pruned to eliminate duplicates Z: 67 41.500 2.373 0.468 0.527 0.939 0.697 CB 1.520 67 residues pruned to eliminate duplicates Z: 151 99.861 2.606 0.809 0.602 0.887 0.673 CA 1.769 151 residues pruned to eliminate duplicates Z: 110 76.629 2.465 0.736 0.601 0.917 0.615 CB 1.698 110 residues pruned to eliminate duplicates Z: 9 2.538 1.433 0.381 0.197 0.750 0.250 CB 0.868 6 residues pruned to eliminate duplicates Z: 7 5.852 1.413 0.532 0.807 1.000 0.500 CB 0.844 Z: 37 43.012 2.543 0.496 0.746 0.944 0.722 CA 1.601 37 residues pruned to eliminate duplicates Z: 17 17.008 2.210 0.414 0.480 0.875 0.688 CB 1.587 17 residues pruned to eliminate duplicates Z: 15 38.137 2.469 1.031 0.921 1.000 0.786 CA 1.430 15 residues pruned to eliminate duplicates Z: 10 10.978 2.333 0.358 0.320 0.889 0.667 CB 1.585 10 residues pruned to eliminate duplicates Z: 6 10.671 1.780 1.253 0.745 1.000 0.800 N 0.955 6 residues pruned to eliminate duplicates Z: 6 4.109 1.757 0.117 0.523 0.800 0.400 CB 1.145 Z: 25 28.631 2.307 0.699 0.484 0.917 0.583 CA 1.654 25 residues pruned to eliminate duplicates Z: 9 7.465 1.822 0.455 0.498 0.875 0.625 CB 1.140 Z: 11 11.349 1.949 0.409 0.656 0.900 0.400 CB 1.256 11 residues pruned to eliminate duplicates Z: 7 4.243 1.566 0.532 0.413 0.833 0.500 N 0.949 Z: 21 38.065 2.154 0.897 0.896 1.000 0.650 CB 1.492 21 residues pruned to eliminate duplicates Z: 20 24.398 2.449 0.369 0.557 0.947 0.789 CA 1.668 20 residues pruned to eliminate duplicates Z: 22 18.775 1.984 0.745 0.691 0.905 0.762 CA 1.098 22 residues pruned to eliminate duplicates Z: 74 66.951 2.540 0.838 0.574 0.904 0.562 CB 1.729 74 residues pruned to eliminate duplicates Z: 21 29.737 2.152 0.623 0.858 1.000 0.650 CB 1.402 21 residues pruned to eliminate duplicates Z: 39 18.832 2.128 0.342 0.495 0.842 0.447 CB 1.276 39 residues pruned to eliminate duplicates Z: 10 12.769 1.997 0.640 0.690 0.889 0.778 CB 1.229 Z: 7 12.174 2.529 0.805 0.316 0.833 0.667 CA 1.602 7 residues pruned to eliminate duplicates Z: 13 17.563 1.854 0.328 0.863 1.000 1.000 CB 1.510 13 residues pruned to eliminate duplicates Z: 22 31.089 2.288 0.612 0.777 1.000 0.810 CA 1.440 22 residues pruned to eliminate duplicates Z: 35 15.697 1.988 0.578 0.252 0.912 0.441 CB 1.252 35 residues pruned to eliminate duplicates Z: 133 69.571 2.478 0.695 0.496 0.864 0.515 CB 1.676 133 residues pruned to eliminate duplicates Z: 8 2.938 1.522 0.270 0.211 0.714 0.286 CA 1.131 8 residues pruned to eliminate duplicates Z: 13 20.166 2.279 0.844 0.700 0.833 0.500 CB 1.385 13 residues pruned to eliminate duplicates Z: 20 32.193 2.186 0.412 0.901 1.000 1.000 CA 1.707 20 residues pruned to eliminate duplicates Z: 9 7.999 1.807 0.423 0.568 0.875 0.625 N 1.177 9 residues pruned to eliminate duplicates Z: 8 17.576 2.072 0.819 0.824 1.000 0.857 CB 1.330 7 residues pruned to eliminate duplicates Z: 8 2.205 1.483 0.727 0.376 0.714 0.286 CB 0.520 Z: 15 25.278 2.571 0.658 0.477 0.929 0.571 CA 1.747 15 residues pruned to eliminate duplicates 6 0.787 1.292 0.453 0.285 0.400 0.400 CB 0.598 ? Z: 24 24.468 2.460 0.533 0.414 0.957 0.696 CB 1.547 24 residues pruned to eliminate duplicates Z: 9 37.958 2.520 1.138 0.832 1.000 0.625 CA 1.870 9 residues pruned to eliminate duplicates Z: 9 16.810 2.160 1.002 0.864 0.875 0.750 CA 1.152 9 residues pruned to eliminate duplicates Z: 8 7.644 1.965 0.825 0.720 0.714 0.429 CB 0.925 8 residues pruned to eliminate duplicates Z: 21 24.432 2.492 0.428 0.654 0.950 0.750 CB 1.401 21 residues pruned to eliminate duplicates Z: 8 3.714 1.736 0.796 0.295 0.714 0.571 N 0.793 8 residues pruned to eliminate duplicates Z: 6 4.185 1.352 0.843 0.552 0.800 0.800 CB 0.892 Z: 6 4.707 1.715 0.794 0.176 0.800 0.600 C 1.265 Z: 18 34.493 2.412 0.737 0.894 0.941 0.706 CA 1.522 18 residues pruned to eliminate duplicates Z: 76 83.657 2.730 0.939 0.607 0.867 0.667 CA 1.903 76 residues pruned to eliminate duplicates Z: 46 39.646 2.554 0.525 0.551 0.889 0.733 CA 1.625 46 residues pruned to eliminate duplicates Z: 6 2.121 1.402 0.684 0.343 0.800 0.600 CB 0.595 Z: 23 24.526 2.092 0.775 0.535 0.909 0.455 CB 1.497 23 residues pruned to eliminate duplicates Z: 20 28.549 2.052 0.679 0.851 0.947 0.684 CB 1.485 20 residues pruned to eliminate duplicates Z: 9 5.010 2.055 0.533 0.427 0.875 0.250 CB 0.693 Z: 7 3.181 1.580 0.375 0.285 0.667 0.333 N 1.141 Z: 19 46.949 2.327 1.002 0.911 0.944 0.778 CA 1.782 19 residues pruned to eliminate duplicates Z: 17 25.276 2.232 0.620 0.638 1.000 0.625 CA 1.535 31 residues pruned to eliminate duplicates Z: 13 11.728 1.992 0.400 0.406 1.000 0.583 CB 1.340 13 residues pruned to eliminate duplicates Z: 22 12.769 2.274 0.304 0.329 0.905 0.429 CB 1.253 22 residues pruned to eliminate duplicates Z: 10 12.237 2.010 0.538 0.887 0.889 0.778 CA 1.070 10 residues pruned to eliminate duplicates Z: 7 11.260 1.772 0.723 0.844 1.000 1.000 CA 1.121 7 residues pruned to eliminate duplicates Z: 20 12.348 2.066 0.420 0.414 0.842 0.474 CB 1.255 27 residues pruned to eliminate duplicates Z: 8 7.104 1.839 0.371 0.425 0.857 0.429 CB 1.342 Z: 16 29.524 2.523 0.752 0.672 1.000 0.733 CA 1.471 16 residues pruned to eliminate duplicates Z: 19 16.231 2.043 0.817 0.480 0.778 0.500 CB 1.353 19 residues pruned to eliminate duplicates Z: 23 23.154 2.016 0.500 0.820 0.955 0.864 CB 1.296 23 residues pruned to eliminate duplicates 6 1.205 1.613 -0.297 0.300 0.800 0.600 C 0.743 ? Z: 8 4.722 1.723 0.591 0.386 0.714 0.429 CA 1.029 Z: 8 3.517 1.778 -0.002 0.351 0.857 0.571 CB 1.028 4 residues pruned to eliminate duplicates Z: 6 4.610 1.687 0.453 0.470 0.800 0.600 CA 1.084 Z: 7 3.779 1.697 -0.258 0.604 1.000 0.667 CB 1.110 Z: 87 58.849 2.513 0.735 0.446 0.907 0.616 CB 1.695 87 residues pruned to eliminate duplicates Z: 83 51.998 2.441 0.442 0.525 0.939 0.646 CB 1.695 83 residues pruned to eliminate duplicates Z: 18 29.183 2.131 0.671 0.892 1.000 0.765 CB 1.427 18 residues pruned to eliminate duplicates Z: 12 28.564 2.742 1.093 0.874 0.909 0.273 CA 1.201 12 residues pruned to eliminate duplicates Z: 6 2.017 1.707 0.545 0.286 0.600 0.400 CB 0.725 Z: 7 10.612 2.149 0.793 0.671 0.667 0.500 CB 1.440 7 residues pruned to eliminate duplicates Z: 8 2.451 1.731 0.772 0.368 0.714 0.571 CB 0.487 Z: 6 6.207 1.677 0.666 0.709 0.800 0.600 N 1.027 6 residues pruned to eliminate duplicates Z: 7 4.757 1.632 0.894 0.520 0.667 0.500 N 0.924 6 1.749 1.272 0.773 0.291 0.800 0.800 C 0.548 ? Z: 20 16.915 2.208 0.707 0.317 0.895 0.474 CB 1.408 20 residues pruned to eliminate duplicates Z: 42 25.034 2.310 0.514 0.431 0.780 0.537 CB 1.539 42 residues pruned to eliminate duplicates Z: 18 40.668 2.713 0.665 0.759 1.000 0.824 CA 1.734 18 residues pruned to eliminate duplicates Z: 20 17.749 2.255 0.481 0.400 0.947 0.579 CB 1.430 20 residues pruned to eliminate duplicates Z: 8 10.892 2.104 0.667 0.713 0.857 0.857 CB 1.129 8 residues pruned to eliminate duplicates Z: 6 2.210 1.672 -0.086 0.331 0.800 0.600 CB 0.973 Z: 53 58.538 2.508 0.807 0.614 0.923 0.673 CB 1.742 53 residues pruned to eliminate duplicates Z: 49 58.051 2.578 1.074 0.692 0.833 0.312 CB 1.578 49 residues pruned to eliminate duplicates 6 1.729 1.409 0.036 0.379 0.800 0.400 N 0.753 ? Z: 27 38.095 2.471 0.617 0.660 0.885 0.615 CA 1.823 27 residues pruned to eliminate duplicates Z: 33 30.645 2.414 0.583 0.481 0.906 0.406 CA 1.595 33 residues pruned to eliminate duplicates Z: 30 25.229 2.276 0.485 0.497 0.931 0.655 CB 1.493 30 residues pruned to eliminate duplicates Z: 6 2.059 1.637 0.394 0.100 0.600 0.400 CA 1.121 Z: 9 3.084 1.614 0.919 0.376 0.625 0.250 CB 0.643 Z: 8 4.129 1.563 0.486 0.795 0.857 0.714 CB 0.605 Z: 6 2.731 1.787 0.364 0.578 0.800 0.400 N 0.581 Z: 10 24.088 2.369 1.228 0.758 1.000 0.556 CA 1.209 10 residues pruned to eliminate duplicates Z: 62 45.224 2.387 0.533 0.523 0.902 0.689 CB 1.716 62 residues pruned to eliminate duplicates Z: 10 4.390 1.729 0.782 0.597 0.667 0.556 CB 0.650 6 1.114 1.640 -0.112 0.143 0.600 0.600 CA 0.887 ? Z: 93 57.072 2.444 0.690 0.493 0.902 0.500 CB 1.609 93 residues pruned to eliminate duplicates Z: 20 39.490 2.442 0.807 0.907 1.000 0.737 CA 1.459 20 residues pruned to eliminate duplicates Z: 9 3.888 1.853 0.147 0.214 0.750 0.625 CA 1.207 Z: 7 4.930 1.529 0.624 0.503 1.000 0.667 CB 0.808 Z: 8 4.926 1.623 0.791 0.307 0.857 0.571 CB 0.926 Z: 8 3.246 1.751 0.217 0.585 0.571 0.286 CB 0.928 Z: 52 38.132 2.370 0.637 0.488 0.922 0.588 CB 1.512 52 residues pruned to eliminate duplicates Z: 28 23.773 2.464 0.572 0.473 0.889 0.481 CB 1.366 28 residues pruned to eliminate duplicates Z: 20 55.704 2.619 1.311 0.894 0.895 0.632 CA 1.693 20 residues pruned to eliminate duplicates Z: 10 40.644 2.607 0.902 0.884 1.000 0.778 CB 1.974 10 residues pruned to eliminate duplicates Z: 19 19.811 2.174 0.632 0.575 0.833 0.667 CA 1.469 19 residues pruned to eliminate duplicates Z: 61 37.371 2.429 0.553 0.433 0.867 0.467 CB 1.582 11 residues pruned to eliminate duplicates Z: 10 6.671 1.868 0.323 0.338 0.778 0.444 CA 1.380 7 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 26 48.159 2.546 0.908 0.870 0.920 0.680 CA 1.573 26 residues pruned to eliminate duplicates Z: 126 107.377 2.653 0.887 0.661 0.896 0.608 CB 1.844 427 residues pruned to eliminate duplicates Z: 25 52.506 2.578 1.066 0.880 0.958 0.792 CA 1.521 25 residues pruned to eliminate duplicates Z: 38 53.218 2.489 0.985 0.674 0.892 0.541 CA 1.690 38 residues pruned to eliminate duplicates Z: 25 48.146 2.587 0.874 0.858 0.958 0.500 CA 1.559 25 residues pruned to eliminate duplicates Z: 94 83.343 2.583 0.844 0.650 0.903 0.559 CB 1.746 94 residues pruned to eliminate duplicates Z: 41 66.947 2.490 0.941 0.751 0.975 0.650 CA 1.795 41 residues pruned to eliminate duplicates Z: 128 86.071 2.511 0.691 0.635 0.906 0.559 CB 1.750 149 residues pruned to eliminate duplicates Z: 38 50.618 2.508 0.865 0.667 0.919 0.541 CA 1.659 38 residues pruned to eliminate duplicates Z: 26 45.351 2.551 0.829 0.802 0.880 0.520 CA 1.697 26 residues pruned to eliminate duplicates Z: 36 52.497 2.513 0.876 0.662 0.914 0.514 CA 1.772 36 residues pruned to eliminate duplicates Z: 100 74.004 2.523 0.747 0.585 0.859 0.636 CB 1.812 100 residues pruned to eliminate duplicates Z: 118 73.498 2.491 0.666 0.582 0.872 0.573 CB 1.736 118 residues pruned to eliminate duplicates Z: 39 54.575 2.431 1.093 0.639 0.895 0.579 CB 1.707 39 residues pruned to eliminate duplicates Z: 66 72.578 2.500 1.059 0.565 0.923 0.462 CA 1.779 66 residues pruned to eliminate duplicates Z: 45 55.258 2.546 1.023 0.667 0.886 0.568 CA 1.563 45 residues pruned to eliminate duplicates Z: 25 64.004 2.606 1.178 0.825 0.958 0.417 CA 1.813 25 residues pruned to eliminate duplicates Z: 95 78.666 2.541 0.856 0.629 0.894 0.606 CB 1.705 95 residues pruned to eliminate duplicates Z: 111 91.535 2.549 0.860 0.634 0.936 0.645 CB 1.734 111 residues pruned to eliminate duplicates Z: 117 79.676 2.514 0.688 0.625 0.931 0.638 CB 1.665 117 residues pruned to eliminate duplicates Z: 93 81.966 2.582 0.802 0.629 0.913 0.554 CB 1.782 93 residues pruned to eliminate duplicates Z: 38 46.337 2.470 0.921 0.632 0.919 0.405 CA 1.543 38 residues pruned to eliminate duplicates Z: 38 49.874 2.481 0.821 0.652 0.946 0.649 CA 1.666 38 residues pruned to eliminate duplicates Z: 106 94.943 2.533 0.911 0.627 0.962 0.581 CB 1.765 106 residues pruned to eliminate duplicates Z: 102 78.753 2.467 0.852 0.584 0.931 0.564 CB 1.700 102 residues pruned to eliminate duplicates Z: 90 78.906 2.520 0.860 0.620 0.921 0.573 CB 1.729 90 residues pruned to eliminate duplicates Z: 57 69.492 2.528 0.936 0.663 0.929 0.554 CB 1.757 57 residues pruned to eliminate duplicates Z: 50 41.260 2.345 0.741 0.566 0.857 0.449 CB 1.580 50 residues pruned to eliminate duplicates Z: 100 72.582 2.542 0.834 0.568 0.869 0.525 CB 1.686 100 residues pruned to eliminate duplicates Z: 93 88.261 2.600 0.902 0.641 0.913 0.489 CB 1.786 93 residues pruned to eliminate duplicates Z: 93 89.144 2.616 0.825 0.645 0.935 0.609 CB 1.818 93 residues pruned to eliminate duplicates Z: 96 88.808 2.582 0.906 0.640 0.947 0.611 CB 1.715 96 residues pruned to eliminate duplicates Z: 59 73.643 2.553 1.112 0.583 0.914 0.500 CB 1.812 59 residues pruned to eliminate duplicates Z: 94 80.681 2.569 0.816 0.634 0.914 0.613 CB 1.730 94 residues pruned to eliminate duplicates Z: 94 83.871 2.571 0.868 0.626 0.903 0.516 CB 1.781 94 residues pruned to eliminate duplicates Z: 10 26.200 2.610 0.918 0.542 1.000 0.556 CB 1.674 Z: 10 24.306 2.241 1.161 0.770 0.889 0.556 CA 1.482 10 residues pruned to eliminate duplicates Z: 10 24.514 2.195 1.240 0.880 0.889 0.556 CA 1.355 10 residues pruned to eliminate duplicates Z: 9 11.556 2.487 0.363 0.442 0.750 0.500 N 1.706 9 residues pruned to eliminate duplicates Z: 11 14.389 2.430 0.514 0.376 0.800 0.500 N 1.764 11 residues pruned to eliminate duplicates Z: 9 18.087 2.630 0.609 0.433 0.875 0.500 CA 1.850 9 residues pruned to eliminate duplicates Z: 14 14.467 2.327 0.352 0.285 0.923 0.462 CA 1.760 14 residues pruned to eliminate duplicates Z: 12 15.438 2.366 0.648 0.330 0.818 0.545 CA 1.757 12 residues pruned to eliminate duplicates Z: 11 15.915 2.445 0.683 0.360 0.800 0.500 CA 1.778 11 residues pruned to eliminate duplicates Z: 19 16.301 2.303 0.578 0.298 0.722 0.389 CB 1.834 12 residues pruned to eliminate duplicates Z: 20 39.846 2.604 0.366 0.903 1.000 0.579 CA 1.832 20 residues pruned to eliminate duplicates Z: 18 33.017 2.636 0.674 0.734 1.000 0.765 CA 1.471 18 residues pruned to eliminate duplicates Z: 65 50.575 2.504 0.603 0.513 0.922 0.656 CA 1.686 39 residues pruned to eliminate duplicates Z: 18 52.885 2.700 0.893 0.908 0.941 0.647 CB 1.894 18 residues pruned to eliminate duplicates Z: 207 99.450 2.503 0.738 0.506 0.917 0.553 CB 1.725 195 residues pruned to eliminate duplicates Z: 18 60.859 2.713 1.103 0.901 0.941 0.412 CA 1.962 22 residues pruned to eliminate duplicates Z: 18 56.018 2.724 0.942 0.941 0.941 0.529 CA 1.894 18 residues pruned to eliminate duplicates Z: 35 37.713 2.372 0.914 0.555 0.824 0.382 CB 1.638 35 residues pruned to eliminate duplicates Z: 27 50.938 2.523 1.233 0.651 0.962 0.731 CA 1.602 27 residues pruned to eliminate duplicates Z: 40 25.379 2.147 0.847 0.503 0.718 0.436 CB 1.423 40 residues pruned to eliminate duplicates Z: 171 85.575 2.511 0.673 0.515 0.888 0.582 CB 1.733 171 residues pruned to eliminate duplicates Z: 38 31.540 2.298 0.757 0.526 0.865 0.541 CB 1.447 38 residues pruned to eliminate duplicates Z: 185 91.474 2.524 0.680 0.534 0.913 0.603 CB 1.683 185 residues pruned to eliminate duplicates Z: 21 57.675 2.641 1.060 0.842 0.950 0.650 CA 1.859 21 residues pruned to eliminate duplicates Z: 28 46.228 2.405 1.159 0.672 0.889 0.481 CB 1.645 28 residues pruned to eliminate duplicates Z: 20 57.414 2.651 1.164 0.834 0.895 0.474 CA 1.924 20 residues pruned to eliminate duplicates Z: 18 62.101 2.669 1.379 0.924 0.941 0.412 CB 1.770 18 residues pruned to eliminate duplicates Z: 13 26.456 2.098 0.735 0.828 0.917 0.750 CA 1.724 Z: 11 21.041 2.363 0.736 0.801 0.700 0.500 CA 1.781 11 residues pruned to eliminate duplicates Z: 12 22.913 2.178 0.616 0.834 0.909 0.364 CB 1.619 12 residues pruned to eliminate duplicates Z: 46 54.033 2.493 0.761 0.724 0.933 0.756 CA 1.606 59 residues pruned to eliminate duplicates Z: 50 55.211 2.460 0.719 0.667 0.939 0.714 CA 1.702 50 residues pruned to eliminate duplicates Z: 108 74.425 2.513 0.689 0.589 0.888 0.701 CB 1.753 118 residues pruned to eliminate duplicates Z: 32 44.594 2.364 0.999 0.640 0.903 0.677 CA 1.645 32 residues pruned to eliminate duplicates Z: 40 57.183 2.480 0.805 0.750 0.974 0.692 CA 1.679 40 residues pruned to eliminate duplicates Z: 13 31.404 2.208 1.063 0.764 0.917 0.417 CB 1.717 Z: 6 4.758 1.456 0.660 0.389 1.000 0.800 CA 0.990 Z: 6 4.004 1.826 0.185 0.488 1.000 0.800 CA 0.838 Z: 6 6.380 1.923 0.822 0.333 0.800 0.600 CA 1.222 Z: 8 5.423 1.756 0.569 0.361 0.714 0.429 N 1.209 Z: 6 7.309 1.698 0.609 0.400 1.000 0.200 N 1.330 14 residues pruned to eliminate duplicates Z: 33 29.319 2.233 0.549 0.577 0.906 0.750 CB 1.536 45 residues pruned to eliminate duplicates Z: 6 8.183 1.978 0.776 0.419 1.000 0.600 CA 1.134 6 residues pruned to eliminate duplicates Z: 29 28.328 2.268 0.569 0.651 0.964 0.643 CB 1.355 29 residues pruned to eliminate duplicates Z: 22 19.871 2.295 0.474 0.432 0.857 0.762 CB 1.605 22 residues pruned to eliminate duplicates Z: 30 26.307 2.258 0.493 0.496 0.931 0.586 CB 1.562 30 residues pruned to eliminate duplicates Z: 9 6.161 1.752 0.396 0.529 0.750 0.500 N 1.154 9 residues pruned to eliminate duplicates Z: 29 16.858 2.099 0.488 0.382 0.821 0.607 CB 1.407 29 residues pruned to eliminate duplicates Z: 32 26.990 2.258 0.485 0.554 0.903 0.742 CB 1.518 32 residues pruned to eliminate duplicates Z: 31 27.653 2.208 0.631 0.502 0.900 0.733 CB 1.555 31 residues pruned to eliminate duplicates Z: 30 22.057 2.145 0.508 0.491 0.828 0.448 CB 1.544 29 residues pruned to eliminate duplicates Z: 18 24.548 2.113 0.507 0.893 1.000 0.765 CB 1.342 18 residues pruned to eliminate duplicates Z: 16 28.209 2.201 0.799 0.933 1.000 0.933 CB 1.284 16 residues pruned to eliminate duplicates Z: 23 21.928 2.023 0.756 0.728 0.955 0.682 CB 1.123 23 residues pruned to eliminate duplicates Z: 21 22.893 2.051 0.537 0.766 1.000 0.800 CB 1.283 21 residues pruned to eliminate duplicates Z: 33 20.637 2.116 0.662 0.544 0.781 0.562 CB 1.272 33 residues pruned to eliminate duplicates Z: 19 26.517 2.137 0.690 0.801 1.000 0.556 CB 1.331 19 residues pruned to eliminate duplicates Z: 22 19.851 2.054 0.479 0.730 0.952 0.619 CB 1.217 22 residues pruned to eliminate duplicates Z: 23 23.147 2.070 0.847 0.792 0.909 0.773 CB 1.099 23 residues pruned to eliminate duplicates Z: 26 21.370 1.988 0.882 0.700 0.880 0.640 CB 1.083 26 residues pruned to eliminate duplicates Z: 21 21.422 2.031 0.766 0.769 0.950 0.700 CB 1.107 21 residues pruned to eliminate duplicates Z: 24 20.423 1.954 0.729 0.733 0.913 0.652 CB 1.119 24 residues pruned to eliminate duplicates Z: 26 17.712 2.016 0.905 0.647 0.880 0.640 CB 0.914 26 residues pruned to eliminate duplicates Z: 21 32.642 2.099 1.064 0.816 1.000 0.900 CB 1.280 19 residues pruned to eliminate duplicates Z: 11 21.631 2.055 0.905 0.862 0.900 0.600 CB 1.425 Z: 12 21.188 1.864 0.956 0.813 0.909 0.727 N 1.468 10 residues pruned to eliminate duplicates Z: 13 21.180 1.984 0.718 0.826 0.917 0.667 CA 1.476 13 residues pruned to eliminate duplicates Z: 25 50.488 2.597 0.895 0.793 0.958 0.792 CA 1.690 38 residues pruned to eliminate duplicates Z: 47 52.882 2.514 0.773 0.704 0.913 0.804 CA 1.592 47 residues pruned to eliminate duplicates Z: 24 45.093 2.584 0.850 0.749 0.913 0.652 CA 1.725 24 residues pruned to eliminate duplicates Z: 29 31.868 2.457 0.730 0.718 0.893 0.643 CA 1.303 29 residues pruned to eliminate duplicates Z: 78 60.658 2.500 0.741 0.564 0.896 0.610 CB 1.667 78 residues pruned to eliminate duplicates Z: 37 55.538 2.645 0.606 0.804 0.972 0.806 CA 1.719 37 residues pruned to eliminate duplicates Z: 55 55.774 2.520 0.771 0.651 0.870 0.685 CA 1.698 55 residues pruned to eliminate duplicates Z: 45 51.883 2.568 0.711 0.698 0.909 0.773 CA 1.635 45 residues pruned to eliminate duplicates Z: 36 54.099 2.598 0.682 0.792 0.914 0.714 CA 1.771 36 residues pruned to eliminate duplicates Z: 30 38.691 2.504 0.673 0.781 0.862 0.759 CA 1.554 30 residues pruned to eliminate duplicates Z: 44 60.117 2.569 0.748 0.730 0.953 0.628 CA 1.741 44 residues pruned to eliminate duplicates Z: 33 51.456 2.534 0.863 0.805 0.875 0.688 CA 1.688 33 residues pruned to eliminate duplicates Z: 45 67.632 2.601 0.781 0.763 1.000 0.750 CA 1.743 45 residues pruned to eliminate duplicates Z: 45 52.988 2.494 0.726 0.674 0.932 0.636 CA 1.697 45 residues pruned to eliminate duplicates Z: 45 56.439 2.582 0.665 0.723 0.932 0.705 CA 1.737 45 residues pruned to eliminate duplicates Z: 36 64.135 2.599 0.932 0.710 0.943 0.629 CA 1.893 36 residues pruned to eliminate duplicates Z: 33 71.484 2.608 0.851 0.854 0.969 0.656 CA 1.996 33 residues pruned to eliminate duplicates Z: 41 69.804 2.613 0.921 0.763 0.925 0.600 CB 1.882 41 residues pruned to eliminate duplicates Z: 44 59.516 2.568 0.720 0.721 0.930 0.651 CB 1.809 44 residues pruned to eliminate duplicates Z: 53 46.100 2.411 1.027 0.534 0.904 0.577 CB 1.399 53 residues pruned to eliminate duplicates Z: 83 77.665 2.540 0.952 0.612 0.902 0.622 CB 1.724 83 residues pruned to eliminate duplicates Z: 54 54.397 2.431 1.014 0.615 0.887 0.472 CB 1.542 54 residues pruned to eliminate duplicates Z: 43 73.435 2.601 0.946 0.748 0.952 0.619 CB 1.884 43 residues pruned to eliminate duplicates Z: 43 66.915 2.582 0.960 0.726 0.952 0.357 CB 1.747 43 residues pruned to eliminate duplicates Z: 51 57.993 2.488 0.918 0.646 0.920 0.720 CB 1.630 51 residues pruned to eliminate duplicates Z: 42 74.362 2.613 1.041 0.760 0.951 0.585 CB 1.817 42 residues pruned to eliminate duplicates Z: 39 55.857 2.602 0.975 0.685 0.868 0.553 CB 1.714 39 residues pruned to eliminate duplicates Z: 65 64.266 2.415 0.886 0.655 0.891 0.531 CB 1.715 99 residues pruned to eliminate duplicates Z: 47 61.579 2.508 0.930 0.709 0.935 0.457 CB 1.661 47 residues pruned to eliminate duplicates Z: 31 38.440 2.513 0.781 0.614 0.800 0.433 CB 1.759 31 residues pruned to eliminate duplicates Z: 13 15.054 2.501 0.497 0.458 0.750 0.583 CB 1.614 13 residues pruned to eliminate duplicates Z: 50 63.571 2.510 1.056 0.649 0.918 0.367 CB 1.669 50 residues pruned to eliminate duplicates Z: 53 52.380 2.454 0.965 0.602 0.904 0.385 CB 1.512 53 residues pruned to eliminate duplicates Z: 38 26.409 2.309 0.388 0.425 0.892 0.703 CA 1.643 38 residues pruned to eliminate duplicates Z: 49 54.700 2.469 1.026 0.627 0.875 0.375 CB 1.600 49 residues pruned to eliminate duplicates Z: 10 10.933 2.450 0.555 0.433 0.667 0.444 CA 1.538 10 residues pruned to eliminate duplicates Z: 11 13.572 2.475 0.400 0.401 0.800 0.300 CB 1.719 11 residues pruned to eliminate duplicates Z: 66 49.507 2.464 0.665 0.513 0.923 0.631 CA 1.601 66 residues pruned to eliminate duplicates Z: 67 63.641 2.528 1.059 0.581 0.864 0.424 CB 1.613 67 residues pruned to eliminate duplicates Z: 46 38.115 2.499 0.808 0.398 0.867 0.600 CB 1.616 46 residues pruned to eliminate duplicates Z: 57 44.236 2.453 0.639 0.520 0.857 0.679 CA 1.681 57 residues pruned to eliminate duplicates Z: 27 32.727 2.572 0.795 0.492 0.808 0.654 CB 1.735 27 residues pruned to eliminate duplicates Z: 58 43.651 2.432 0.672 0.516 0.895 0.632 CA 1.565 58 residues pruned to eliminate duplicates Z: 58 48.593 2.403 0.841 0.521 0.860 0.667 CB 1.657 67 residues pruned to eliminate duplicates Z: 17 20.396 2.475 0.751 0.423 0.812 0.625 CB 1.568 17 residues pruned to eliminate duplicates Z: 11 15.908 2.587 0.995 0.450 0.800 0.500 CB 1.283 11 residues pruned to eliminate duplicates Z: 43 27.656 2.270 0.638 0.416 0.833 0.571 CA 1.505 43 residues pruned to eliminate duplicates Z: 39 31.797 2.406 0.732 0.413 0.868 0.579 CB 1.562 39 residues pruned to eliminate duplicates Z: 27 33.664 2.533 0.790 0.473 0.885 0.538 CB 1.692 27 residues pruned to eliminate duplicates Z: 59 45.662 2.448 0.732 0.502 0.845 0.672 CB 1.670 59 residues pruned to eliminate duplicates Z: 36 33.578 2.417 0.836 0.419 0.886 0.600 CB 1.571 36 residues pruned to eliminate duplicates Z: 91 56.225 2.451 0.783 0.519 0.811 0.556 CB 1.640 91 residues pruned to eliminate duplicates Z: 33 34.770 2.510 0.895 0.463 0.812 0.531 CB 1.651 33 residues pruned to eliminate duplicates Z: 58 44.541 2.447 0.757 0.517 0.842 0.632 CB 1.603 58 residues pruned to eliminate duplicates Z: 59 53.436 2.420 0.873 0.595 0.862 0.672 CB 1.640 60 residues pruned to eliminate duplicates Z: 13 13.538 1.952 1.250 0.566 0.667 0.583 CA 1.252 13 residues pruned to eliminate duplicates Z: 45 38.682 2.477 0.701 0.517 0.864 0.705 CA 1.577 45 residues pruned to eliminate duplicates Z: 105 75.642 2.481 0.828 0.591 0.923 0.529 CB 1.623 105 residues pruned to eliminate duplicates Z: 31 30.182 2.384 1.034 0.420 0.800 0.567 CB 1.543 31 residues pruned to eliminate duplicates Z: 38 29.654 2.345 0.893 0.399 0.811 0.568 CB 1.506 38 residues pruned to eliminate duplicates Z: 38 38.112 2.581 0.829 0.448 0.865 0.568 CB 1.618 38 residues pruned to eliminate duplicates Z: 37 33.854 2.420 0.872 0.407 0.861 0.556 CB 1.594 37 residues pruned to eliminate duplicates Z: 104 72.518 2.469 0.829 0.585 0.883 0.476 CB 1.651 104 residues pruned to eliminate duplicates Z: 101 61.711 2.432 0.818 0.536 0.870 0.520 CB 1.548 101 residues pruned to eliminate duplicates Z: 58 46.582 2.463 0.713 0.506 0.912 0.632 CA 1.592 58 residues pruned to eliminate duplicates Z: 123 72.827 2.416 0.871 0.577 0.861 0.525 CB 1.574 123 residues pruned to eliminate duplicates Z: 67 49.164 2.496 0.748 0.490 0.879 0.621 CB 1.593 67 residues pruned to eliminate duplicates Z: 57 48.319 2.479 0.725 0.504 0.911 0.643 CA 1.652 57 residues pruned to eliminate duplicates Z: 57 43.389 2.447 0.706 0.507 0.875 0.643 CB 1.577 57 residues pruned to eliminate duplicates Z: 31 31.093 2.319 0.663 0.568 0.900 0.733 CB 1.532 31 residues pruned to eliminate duplicates Z: 31 25.916 2.294 0.518 0.574 0.900 0.667 CB 1.406 31 residues pruned to eliminate duplicates Z: 59 54.149 2.492 0.787 0.568 0.914 0.690 CB 1.636 59 residues pruned to eliminate duplicates Z: 62 51.962 2.410 0.797 0.544 0.902 0.656 CB 1.633 59 residues pruned to eliminate duplicates Z: 19 32.391 2.273 0.746 0.941 1.000 0.944 CA 1.335 19 residues pruned to eliminate duplicates Z: 61 49.015 2.471 0.766 0.538 0.867 0.667 CB 1.613 63 residues pruned to eliminate duplicates Z: 19 29.891 2.272 0.452 0.913 1.000 0.833 CA 1.511 19 residues pruned to eliminate duplicates Z: 58 50.229 2.442 0.836 0.566 0.895 0.684 CB 1.555 58 residues pruned to eliminate duplicates Z: 20 38.106 2.202 0.959 0.905 1.000 0.579 CA 1.443 20 residues pruned to eliminate duplicates Z: 104 80.083 2.510 0.926 0.628 0.893 0.573 CB 1.621 104 residues pruned to eliminate duplicates Z: 60 46.548 2.409 0.844 0.550 0.847 0.610 CB 1.532 60 residues pruned to eliminate duplicates Z: 69 53.846 2.468 0.825 0.531 0.912 0.632 CB 1.542 69 residues pruned to eliminate duplicates Z: 60 54.638 2.450 0.887 0.560 0.898 0.593 CB 1.615 60 residues pruned to eliminate duplicates Z: 62 47.454 2.403 0.793 0.516 0.869 0.656 CA 1.597 62 residues pruned to eliminate duplicates Z: 109 81.271 2.473 0.912 0.628 0.889 0.546 CB 1.649 109 residues pruned to eliminate duplicates Z: 105 80.331 2.483 0.907 0.622 0.904 0.548 CB 1.640 105 residues pruned to eliminate duplicates Z: 59 55.599 2.453 0.847 0.591 0.914 0.672 CB 1.616 59 residues pruned to eliminate duplicates Z: 60 49.529 2.432 0.838 0.568 0.864 0.678 CB 1.562 60 residues pruned to eliminate duplicates Z: 60 53.795 2.449 0.932 0.580 0.864 0.492 CB 1.586 60 residues pruned to eliminate duplicates Z: 19 37.184 2.288 0.927 0.898 0.944 0.722 CB 1.505 19 residues pruned to eliminate duplicates Z: 63 51.889 2.433 0.950 0.514 0.839 0.581 CB 1.633 78 residues pruned to eliminate duplicates Z: 33 41.697 2.352 0.806 0.678 0.969 0.688 CB 1.520 33 residues pruned to eliminate duplicates Z: 60 51.165 2.463 0.848 0.567 0.864 0.695 CB 1.587 60 residues pruned to eliminate duplicates Z: 59 51.166 2.481 0.699 0.586 0.879 0.603 CB 1.668 59 residues pruned to eliminate duplicates Z: 31 40.159 2.395 0.768 0.695 0.933 0.733 CB 1.553 31 residues pruned to eliminate duplicates Z: 31 39.871 2.376 0.921 0.701 0.867 0.667 CB 1.533 31 residues pruned to eliminate duplicates Z: 34 33.724 2.206 0.700 0.641 0.909 0.606 CB 1.509 34 residues pruned to eliminate duplicates Z: 68 53.036 2.484 0.714 0.547 0.866 0.657 CA 1.679 68 residues pruned to eliminate duplicates Z: 68 47.368 2.344 0.785 0.561 0.866 0.582 CB 1.507 80 residues pruned to eliminate duplicates Z: 108 85.744 2.498 0.926 0.630 0.925 0.514 CB 1.648 108 residues pruned to eliminate duplicates Z: 10 7.815 1.754 0.722 0.442 0.667 0.444 N 1.372 6 1.775 1.197 1.004 0.139 0.800 0.400 O 0.647 ? Z: 12 22.329 2.026 0.444 0.885 1.000 0.818 CB 1.661 Z: 12 20.528 2.038 0.775 0.852 0.909 0.727 CB 1.392 12 residues pruned to eliminate duplicates Z: 22 22.492 2.289 0.323 0.741 0.905 0.762 CB 1.443 12 residues pruned to eliminate duplicates Z: 11 16.047 2.061 0.303 0.834 0.900 0.800 CB 1.573 11 residues pruned to eliminate duplicates Z: 24 21.357 2.252 0.279 0.637 0.957 0.826 CB 1.421 24 residues pruned to eliminate duplicates Z: 34 26.196 2.222 0.333 0.596 0.879 0.758 CB 1.598 28 residues pruned to eliminate duplicates Z: 13 18.364 1.862 0.601 0.875 0.917 0.667 CA 1.411 12 residues pruned to eliminate duplicates Z: 7 7.282 2.101 0.445 0.429 0.667 0.167 N 1.581 7 residues pruned to eliminate duplicates Z: 18 20.197 2.322 0.521 0.442 1.000 0.706 CB 1.473 18 residues pruned to eliminate duplicates Z: 6 6.589 1.515 1.302 0.512 0.800 0.600 CB 1.044 6 residues pruned to eliminate duplicates Z: 19 19.809 2.288 0.614 0.441 0.944 0.667 CB 1.423 18 residues pruned to eliminate duplicates Z: 6 15.963 2.213 0.936 0.393 1.000 0.400 CA 1.866 6 residues pruned to eliminate duplicates Z: 19 15.172 2.292 0.457 0.419 0.833 0.556 CB 1.399 19 residues pruned to eliminate duplicates Z: 21 16.339 2.155 0.338 0.406 0.950 0.500 CB 1.473 21 residues pruned to eliminate duplicates Z: 28 18.350 2.103 0.607 0.321 0.926 0.481 CB 1.375 28 residues pruned to eliminate duplicates Z: 19 17.145 2.274 0.539 0.437 0.944 0.667 CB 1.306 19 residues pruned to eliminate duplicates Z: 6 7.902 1.615 0.946 0.688 0.800 0.800 CA 1.183 Z: 7 13.488 1.993 0.867 0.390 1.000 0.500 CA 1.662 6 residues pruned to eliminate duplicates Z: 7 14.464 1.984 0.766 0.541 1.000 0.667 CA 1.619 7 residues pruned to eliminate duplicates Z: 6 11.576 1.966 0.702 0.476 1.000 0.800 CA 1.585 5 residues pruned to eliminate duplicates Z: 6 3.538 1.433 0.577 0.297 0.800 0.400 CB 1.098 Z: 7 9.892 2.218 0.640 0.469 0.667 0.500 N 1.719 7 residues pruned to eliminate duplicates Z: 15 9.263 1.850 0.735 0.401 0.786 0.500 CB 1.090 6 residues pruned to eliminate duplicates Z: 7 11.258 1.754 0.777 0.731 1.000 0.500 N 1.198 7 residues pruned to eliminate duplicates Z: 67 45.228 2.498 0.556 0.483 0.864 0.485 CB 1.688 67 residues pruned to eliminate duplicates Z: 71 59.249 2.574 0.652 0.515 0.943 0.586 CB 1.739 71 residues pruned to eliminate duplicates Z: 68 54.142 2.584 0.610 0.450 0.940 0.582 CB 1.781 68 residues pruned to eliminate duplicates Z: 23 26.533 2.278 0.813 0.414 0.909 0.545 CA 1.649 23 residues pruned to eliminate duplicates Z: 74 55.379 2.553 0.569 0.526 0.918 0.575 CB 1.718 79 residues pruned to eliminate duplicates Z: 18 30.965 2.420 0.830 0.638 0.941 0.529 CA 1.584 18 residues pruned to eliminate duplicates Z: 19 28.937 2.491 0.855 0.539 0.944 0.667 CA 1.503 19 residues pruned to eliminate duplicates Z: 20 32.801 2.434 0.927 0.541 1.000 0.632 CA 1.542 19 residues pruned to eliminate duplicates Z: 7 14.792 2.296 0.449 0.834 1.000 0.833 CB 1.361 Z: 19 43.102 2.461 1.229 0.931 0.944 0.667 CA 1.370 26 residues pruned to eliminate duplicates Z: 26 35.201 2.417 0.892 0.526 0.880 0.520 CA 1.704 26 residues pruned to eliminate duplicates Z: 77 42.686 2.424 0.628 0.406 0.868 0.421 CB 1.577 77 residues pruned to eliminate duplicates Z: 28 22.114 2.160 0.612 0.407 0.889 0.593 CA 1.517 28 residues pruned to eliminate duplicates Z: 74 59.800 2.548 0.653 0.513 0.945 0.589 CB 1.736 74 residues pruned to eliminate duplicates Z: 148 84.291 2.548 0.677 0.542 0.891 0.619 CB 1.753 148 residues pruned to eliminate duplicates Z: 73 59.347 2.538 0.691 0.522 0.931 0.597 CB 1.714 73 residues pruned to eliminate duplicates Z: 54 42.722 2.509 0.589 0.485 0.943 0.547 CB 1.583 54 residues pruned to eliminate duplicates Z: 76 46.809 2.509 0.562 0.446 0.880 0.600 CB 1.656 76 residues pruned to eliminate duplicates Z: 64 46.556 2.557 0.559 0.493 0.857 0.603 CB 1.729 64 residues pruned to eliminate duplicates Z: 61 46.294 2.520 0.599 0.495 0.933 0.617 CB 1.597 61 residues pruned to eliminate duplicates Z: 48 38.893 2.539 0.528 0.488 0.872 0.574 CB 1.695 48 residues pruned to eliminate duplicates Z: 105 77.898 2.589 0.693 0.524 0.923 0.615 CA 1.844 105 residues pruned to eliminate duplicates Z: 116 67.961 2.588 0.546 0.507 0.887 0.574 CB 1.773 116 residues pruned to eliminate duplicates Z: 101 78.235 2.607 0.770 0.542 0.920 0.560 CB 1.769 101 residues pruned to eliminate duplicates Z: 75 55.535 2.499 0.668 0.504 0.919 0.541 CB 1.679 75 residues pruned to eliminate duplicates Z: 134 78.249 2.563 0.571 0.554 0.910 0.669 CB 1.758 134 residues pruned to eliminate duplicates Z: 87 36.339 2.341 0.421 0.369 0.872 0.535 CB 1.553 87 residues pruned to eliminate duplicates Z: 156 65.870 2.462 0.548 0.453 0.871 0.626 CB 1.673 40 residues pruned to eliminate duplicates Z: 6 5.454 1.881 0.684 0.287 0.800 0.400 CA 1.223 Z: 9 12.178 2.125 0.432 0.472 0.875 0.625 N 1.663 Z: 6 11.909 2.114 0.761 0.378 1.000 0.600 N 1.629 Z: 6 4.695 2.177 0.429 0.469 1.000 0.800 CA 0.696 Z: 8 8.554 2.129 0.500 0.547 1.000 1.000 CA 0.968 7 residues pruned to eliminate duplicates Z: 12 11.275 1.859 1.106 0.519 0.909 0.727 CA 0.937 Z: 6 2.990 2.111 0.213 0.516 0.800 0.800 CB 0.642 6 residues pruned to eliminate duplicates Z: 59 46.796 2.540 0.670 0.494 0.862 0.500 CB 1.691 59 residues pruned to eliminate duplicates Z: 76 65.588 2.614 0.716 0.502 0.947 0.640 CA 1.780 76 residues pruned to eliminate duplicates Z: 88 41.489 2.362 0.485 0.385 0.908 0.506 CB 1.578 88 residues pruned to eliminate duplicates Z: 50 46.433 2.606 0.587 0.515 0.878 0.694 CB 1.800 50 residues pruned to eliminate duplicates Z: 70 58.253 2.558 0.719 0.479 0.942 0.536 CB 1.729 70 residues pruned to eliminate duplicates Z: 54 48.791 2.648 0.515 0.515 0.925 0.566 CB 1.781 54 residues pruned to eliminate duplicates Z: 130 80.712 2.564 0.652 0.534 0.884 0.612 CB 1.837 130 residues pruned to eliminate duplicates Z: 71 61.052 2.557 0.781 0.485 0.914 0.571 CB 1.779 71 residues pruned to eliminate duplicates Z: 64 52.337 2.528 0.729 0.503 0.952 0.556 CB 1.579 64 residues pruned to eliminate duplicates Z: 99 50.824 2.430 0.563 0.429 0.898 0.561 CB 1.621 99 residues pruned to eliminate duplicates Z: 78 52.106 2.525 0.537 0.482 0.922 0.610 CB 1.690 78 residues pruned to eliminate duplicates Z: 34 41.495 2.639 0.679 0.474 0.970 0.667 CB 1.726 34 residues pruned to eliminate duplicates Z: 87 49.929 2.422 0.608 0.448 0.907 0.581 CB 1.607 87 residues pruned to eliminate duplicates Z: 35 39.011 2.632 0.585 0.439 1.000 0.647 CB 1.707 35 residues pruned to eliminate duplicates Z: 224 90.639 2.409 0.731 0.519 0.910 0.583 CB 1.570 224 residues pruned to eliminate duplicates Z: 41 39.031 2.594 0.500 0.492 0.900 0.600 CB 1.776 41 residues pruned to eliminate duplicates Z: 63 56.643 2.548 0.734 0.488 0.952 0.613 CB 1.732 63 residues pruned to eliminate duplicates Z: 47 52.377 2.674 0.694 0.508 0.957 0.674 CB 1.768 47 residues pruned to eliminate duplicates Z: 127 65.917 2.481 0.536 0.468 0.929 0.643 CB 1.714 127 residues pruned to eliminate duplicates Z: 18 23.255 2.457 0.647 0.489 0.941 0.647 CB 1.498 18 residues pruned to eliminate duplicates Z: 126 60.545 2.438 0.528 0.446 0.912 0.576 CB 1.685 126 residues pruned to eliminate duplicates Z: 77 51.021 2.516 0.594 0.448 0.908 0.513 CB 1.695 77 residues pruned to eliminate duplicates Z: 88 57.062 2.553 0.596 0.499 0.874 0.609 CB 1.720 88 residues pruned to eliminate duplicates Z: 73 58.398 2.559 0.679 0.512 0.944 0.472 CB 1.676 73 residues pruned to eliminate duplicates Z: 130 81.098 2.571 0.683 0.526 0.899 0.574 CB 1.789 130 residues pruned to eliminate duplicates Z: 61 47.119 2.571 0.516 0.510 0.917 0.667 CB 1.687 61 residues pruned to eliminate duplicates Z: 76 65.261 2.642 0.680 0.545 0.907 0.667 CA 1.791 76 residues pruned to eliminate duplicates Z: 121 78.077 2.608 0.619 0.536 0.908 0.675 CB 1.794 121 residues pruned to eliminate duplicates Z: 110 77.220 2.648 0.657 0.513 0.936 0.642 CB 1.778 110 residues pruned to eliminate duplicates Z: 49 40.007 2.540 0.677 0.410 0.917 0.542 CB 1.625 49 residues pruned to eliminate duplicates Z: 82 75.722 2.601 0.771 0.565 0.926 0.691 CB 1.852 82 residues pruned to eliminate duplicates Z: 120 74.513 2.579 0.643 0.517 0.891 0.622 CB 1.779 120 residues pruned to eliminate duplicates Z: 129 81.729 2.601 0.736 0.526 0.906 0.648 CB 1.721 129 residues pruned to eliminate duplicates Z: 70 62.360 2.618 0.702 0.527 0.928 0.638 CB 1.770 114 residues pruned to eliminate duplicates Z: 6 28.657 2.898 0.722 0.658 1.000 0.600 CA 2.218 6 residues pruned to eliminate duplicates Z: 115 74.928 2.591 0.693 0.526 0.904 0.667 CB 1.727 115 residues pruned to eliminate duplicates Z: 63 58.540 2.598 0.670 0.587 0.887 0.677 CB 1.776 63 residues pruned to eliminate duplicates Z: 38 47.265 2.586 0.742 0.676 0.973 0.757 CA 1.507 38 residues pruned to eliminate duplicates Z: 92 73.196 2.495 0.762 0.626 0.901 0.692 CA 1.720 92 residues pruned to eliminate duplicates Z: 73 64.100 2.535 0.815 0.628 0.903 0.667 CB 1.612 73 residues pruned to eliminate duplicates Z: 81 65.601 2.494 0.811 0.539 0.887 0.650 CA 1.761 81 residues pruned to eliminate duplicates Z: 89 67.806 2.471 0.769 0.589 0.898 0.636 CB 1.693 89 residues pruned to eliminate duplicates Z: 148 79.726 2.385 0.720 0.577 0.925 0.667 CB 1.609 148 residues pruned to eliminate duplicates Z: 63 67.620 2.510 0.908 0.645 0.935 0.565 CA 1.674 63 residues pruned to eliminate duplicates Z: 115 80.973 2.481 0.715 0.618 0.930 0.658 CB 1.715 115 residues pruned to eliminate duplicates Z: 75 65.043 2.518 0.809 0.618 0.905 0.608 CB 1.640 75 residues pruned to eliminate duplicates Z: 43 64.491 2.667 0.971 0.687 0.905 0.643 CA 1.763 43 residues pruned to eliminate duplicates Z: 75 63.863 2.477 0.947 0.597 0.878 0.622 CB 1.597 75 residues pruned to eliminate duplicates Z: 124 81.909 2.456 0.773 0.623 0.902 0.683 CB 1.674 124 residues pruned to eliminate duplicates Z: 51 55.065 2.443 1.017 0.685 0.920 0.740 CA 1.450 51 residues pruned to eliminate duplicates Z: 92 71.721 2.467 0.838 0.627 0.901 0.571 CB 1.633 92 residues pruned to eliminate duplicates Z: 35 54.855 2.567 1.212 0.711 0.882 0.441 CB 1.550 35 residues pruned to eliminate duplicates Z: 93 69.861 2.466 0.861 0.618 0.902 0.587 CB 1.574 93 residues pruned to eliminate duplicates Z: 81 75.199 2.530 0.901 0.614 0.925 0.625 CB 1.696 81 residues pruned to eliminate duplicates Z: 73 66.850 2.492 0.992 0.618 0.917 0.569 CB 1.547 73 residues pruned to eliminate duplicates Z: 73 73.691 2.523 1.093 0.627 0.917 0.542 CB 1.592 73 residues pruned to eliminate duplicates Z: 100 70.114 2.445 0.875 0.612 0.859 0.657 CB 1.611 75 residues pruned to eliminate duplicates Z: 11 19.356 2.553 0.628 0.571 0.800 0.400 CB 1.719 11 residues pruned to eliminate duplicates Z: 90 77.439 2.504 0.908 0.631 0.910 0.551 CB 1.670 90 residues pruned to eliminate duplicates Z: 31 28.626 2.511 0.629 0.423 0.833 0.533 CB 1.660 31 residues pruned to eliminate duplicates Z: 73 68.851 2.530 0.983 0.618 0.917 0.583 CB 1.579 73 residues pruned to eliminate duplicates Z: 75 59.408 2.449 0.879 0.564 0.919 0.473 CB 1.535 75 residues pruned to eliminate duplicates Z: 30 28.491 2.512 0.603 0.433 0.862 0.586 CB 1.632 30 residues pruned to eliminate duplicates Z: 62 59.228 2.574 0.917 0.565 0.902 0.525 CB 1.601 62 residues pruned to eliminate duplicates Z: 73 70.690 2.514 1.052 0.623 0.931 0.583 CB 1.545 73 residues pruned to eliminate duplicates Z: 73 63.324 2.535 0.844 0.608 0.931 0.625 CB 1.547 73 residues pruned to eliminate duplicates Z: 81 72.007 2.531 0.850 0.618 0.925 0.625 CB 1.662 81 residues pruned to eliminate duplicates Z: 19 28.212 2.592 0.575 0.539 0.833 0.444 CA 1.882 19 residues pruned to eliminate duplicates Z: 54 61.037 2.634 0.860 0.574 0.906 0.528 CB 1.759 54 residues pruned to eliminate duplicates Z: 131 73.972 2.575 0.704 0.482 0.892 0.554 CB 1.688 131 residues pruned to eliminate duplicates Z: 88 74.502 2.508 0.847 0.576 0.954 0.575 CB 1.680 88 residues pruned to eliminate duplicates Z: 85 56.100 2.370 0.641 0.566 0.881 0.571 CB 1.676 85 residues pruned to eliminate duplicates Z: 58 70.442 2.644 1.068 0.602 0.947 0.509 CB 1.635 58 residues pruned to eliminate duplicates Z: 81 76.582 2.530 0.912 0.609 0.925 0.562 CB 1.725 88 residues pruned to eliminate duplicates Z: 6 7.310 2.036 1.205 0.364 0.600 0.600 CA 1.404 6 residues pruned to eliminate duplicates Z: 96 77.587 2.468 0.883 0.603 0.926 0.684 CB 1.676 89 residues pruned to eliminate duplicates Z: 6 9.499 1.952 0.669 0.468 1.000 0.800 CA 1.347 6 residues pruned to eliminate duplicates Z: 96 69.052 2.421 0.825 0.587 0.926 0.674 CB 1.593 96 residues pruned to eliminate duplicates Z: 28 38.952 2.582 0.721 0.465 0.963 0.556 CB 1.816 28 residues pruned to eliminate duplicates Z: 30 33.753 2.549 0.651 0.447 0.931 0.621 CB 1.688 30 residues pruned to eliminate duplicates Z: 61 68.360 2.617 0.970 0.594 0.950 0.600 CB 1.647 61 residues pruned to eliminate duplicates Z: 75 65.709 2.481 0.973 0.599 0.919 0.527 CB 1.546 75 residues pruned to eliminate duplicates Z: 79 66.148 2.495 0.873 0.569 0.859 0.628 CB 1.745 79 residues pruned to eliminate duplicates Z: 64 71.902 2.550 1.053 0.617 0.921 0.651 CB 1.683 64 residues pruned to eliminate duplicates Z: 78 67.143 2.492 0.826 0.605 0.909 0.636 CB 1.673 78 residues pruned to eliminate duplicates Z: 48 42.380 2.465 0.551 0.508 0.936 0.617 CB 1.713 48 residues pruned to eliminate duplicates Z: 90 77.168 2.505 0.865 0.613 0.944 0.539 CB 1.667 90 residues pruned to eliminate duplicates Z: 23 20.607 2.207 0.462 0.542 0.818 0.636 CB 1.596 23 residues pruned to eliminate duplicates Z: 81 56.543 2.431 0.633 0.564 0.925 0.625 CB 1.618 81 residues pruned to eliminate duplicates Z: 93 71.044 2.438 0.938 0.599 0.935 0.478 CB 1.526 93 residues pruned to eliminate duplicates Z: 47 42.149 2.497 0.547 0.520 0.891 0.652 CB 1.770 47 residues pruned to eliminate duplicates Z: 19 30.392 2.323 0.542 0.670 0.944 0.778 CA 1.809 19 residues pruned to eliminate duplicates Z: 81 67.473 2.540 0.797 0.594 0.913 0.550 CB 1.655 81 residues pruned to eliminate duplicates Z: 81 58.892 2.415 0.703 0.560 0.887 0.675 CB 1.702 82 residues pruned to eliminate duplicates Z: 17 32.617 2.174 0.864 0.863 0.875 0.625 CB 1.687 17 residues pruned to eliminate duplicates Z: 95 78.466 2.468 0.942 0.637 0.915 0.606 CB 1.622 95 residues pruned to eliminate duplicates Z: 80 67.792 2.513 0.858 0.598 0.911 0.582 CB 1.632 80 residues pruned to eliminate duplicates Z: 21 28.775 2.281 0.521 0.601 0.950 0.600 CB 1.774 21 residues pruned to eliminate duplicates Z: 89 66.410 2.490 0.721 0.583 0.909 0.511 CB 1.678 89 residues pruned to eliminate duplicates Z: 116 72.717 2.477 0.679 0.591 0.904 0.565 CB 1.653 87 residues pruned to eliminate duplicates Z: 11 28.796 2.398 0.536 0.875 1.000 0.700 N 1.799 11 residues pruned to eliminate duplicates Z: 125 85.598 2.458 0.847 0.615 0.927 0.621 CB 1.637 126 residues pruned to eliminate duplicates Z: 6 4.158 1.817 0.613 0.298 0.800 0.400 N 0.994 Z: 6 11.646 2.017 0.408 0.630 1.000 0.400 N 1.624 Z: 6 2.978 1.610 0.223 0.255 0.800 0.600 CA 1.120 12 residues pruned to eliminate duplicates Z: 120 74.615 2.400 0.790 0.576 0.916 0.630 CB 1.615 120 residues pruned to eliminate duplicates Z: 113 72.884 2.454 0.721 0.587 0.911 0.625 CB 1.648 113 residues pruned to eliminate duplicates Z: 36 39.799 2.366 0.575 0.600 0.971 0.686 CB 1.689 36 residues pruned to eliminate duplicates Z: 99 50.818 2.318 0.556 0.510 0.898 0.633 CB 1.570 99 residues pruned to eliminate duplicates Z: 37 37.491 2.309 0.577 0.598 0.944 0.694 CB 1.655 43 residues pruned to eliminate duplicates Z: 80 55.930 2.449 0.542 0.566 0.924 0.671 CB 1.692 80 residues pruned to eliminate duplicates Z: 104 70.488 2.499 0.645 0.584 0.913 0.553 CB 1.707 104 residues pruned to eliminate duplicates Z: 8 7.611 1.872 0.762 0.328 0.857 0.571 CA 1.229 8 residues pruned to eliminate duplicates Z: 80 55.380 2.438 0.658 0.551 0.886 0.595 CB 1.655 80 residues pruned to eliminate duplicates Z: 209 91.222 2.458 0.640 0.536 0.923 0.635 CB 1.640 209 residues pruned to eliminate duplicates Z: 126 81.008 2.433 0.816 0.597 0.936 0.624 CB 1.597 125 residues pruned to eliminate duplicates Z: 21 33.057 2.164 0.778 0.919 0.950 0.900 CB 1.425 21 residues pruned to eliminate duplicates Z: 127 79.932 2.418 0.869 0.614 0.921 0.619 CB 1.537 127 residues pruned to eliminate duplicates Z: 116 83.753 2.477 0.799 0.591 0.957 0.591 CB 1.680 116 residues pruned to eliminate duplicates Z: 38 41.816 2.341 0.769 0.603 0.919 0.730 CB 1.638 38 residues pruned to eliminate duplicates Z: 125 76.583 2.421 0.835 0.601 0.871 0.573 CB 1.615 125 residues pruned to eliminate duplicates Z: 21 38.931 2.170 0.921 0.903 1.000 0.850 CB 1.489 20 residues pruned to eliminate duplicates Z: 22 36.700 2.144 0.778 0.889 1.000 0.810 CB 1.512 22 residues pruned to eliminate duplicates Z: 112 83.475 2.499 0.869 0.615 0.910 0.604 CB 1.672 114 residues pruned to eliminate duplicates Z: 21 37.518 2.199 0.749 0.927 1.000 0.800 CA 1.529 19 residues pruned to eliminate duplicates Z: 19 43.972 2.287 0.948 0.934 1.000 0.889 CA 1.623 19 residues pruned to eliminate duplicates Z: 81 58.248 2.443 0.607 0.588 0.900 0.688 CB 1.694 81 residues pruned to eliminate duplicates Z: 116 80.897 2.489 0.803 0.601 0.922 0.591 CB 1.657 116 residues pruned to eliminate duplicates Z: 135 68.593 2.402 0.736 0.544 0.888 0.537 CB 1.533 135 residues pruned to eliminate duplicates Z: 80 57.577 2.454 0.643 0.562 0.899 0.646 CB 1.684 80 residues pruned to eliminate duplicates Z: 59 43.424 2.320 0.595 0.581 0.931 0.621 CB 1.531 59 residues pruned to eliminate duplicates Z: 129 78.745 2.409 0.729 0.614 0.906 0.609 CB 1.655 129 residues pruned to eliminate duplicates Z: 80 59.285 2.408 0.658 0.562 0.924 0.671 CB 1.703 80 residues pruned to eliminate duplicates Z: 22 12.687 2.028 0.263 0.331 0.952 0.667 CB 1.365 22 residues pruned to eliminate duplicates Z: 160 75.701 2.376 0.682 0.523 0.918 0.610 CB 1.599 118 residues pruned to eliminate duplicates Z: 6 5.220 1.893 0.248 0.463 0.800 0.000 CB 1.282 Z: 6 3.762 1.714 0.321 0.314 0.800 0.800 O 1.141 Z: 9 9.740 1.767 0.569 0.641 1.000 0.875 CA 1.088 9 residues pruned to eliminate duplicates Z: 14 9.337 2.003 0.222 0.285 0.923 0.462 CA 1.460 14 residues pruned to eliminate duplicates Z: 12 8.445 2.016 0.582 0.243 0.818 0.545 CB 1.313 12 residues pruned to eliminate duplicates Z: 48 20.776 2.087 0.457 0.316 0.872 0.489 CB 1.401 55 residues pruned to eliminate duplicates Z: 6 6.543 1.908 0.346 0.583 0.800 0.600 CB 1.315 Z: 6 3.607 1.664 0.480 0.267 0.800 0.400 N 1.068 6 residues pruned to eliminate duplicates Z: 132 80.153 2.570 0.634 0.521 0.924 0.649 CB 1.769 132 residues pruned to eliminate duplicates Z: 62 41.740 2.464 0.501 0.443 0.918 0.623 CB 1.669 30 residues pruned to eliminate duplicates Z: 6 15.168 2.353 0.700 0.414 1.000 1.000 CA 1.855 6 residues pruned to eliminate duplicates Z: 20 15.214 2.294 0.414 0.313 0.842 0.526 CB 1.570 20 residues pruned to eliminate duplicates Z: 81 38.592 2.220 0.569 0.428 0.875 0.600 CB 1.527 81 residues pruned to eliminate duplicates Z: 43 17.244 2.107 0.405 0.262 0.881 0.500 CB 1.339 43 residues pruned to eliminate duplicates Z: 21 12.846 2.273 0.324 0.262 0.800 0.400 CB 1.566 21 residues pruned to eliminate duplicates Z: 23 13.973 2.253 0.465 0.282 0.818 0.545 CB 1.411 23 residues pruned to eliminate duplicates Z: 28 19.763 2.238 0.257 0.414 0.926 0.667 CB 1.598 28 residues pruned to eliminate duplicates Z: 22 14.125 2.235 0.380 0.298 0.762 0.333 CB 1.643 22 residues pruned to eliminate duplicates Z: 19 15.353 2.262 0.539 0.401 0.722 0.444 CB 1.596 19 residues pruned to eliminate duplicates Z: 24 31.189 2.221 0.693 0.802 0.913 0.783 CB 1.456 24 residues pruned to eliminate duplicates Z: 24 24.788 2.130 0.374 0.774 1.000 0.652 CB 1.385 24 residues pruned to eliminate duplicates Z: 32 23.935 2.026 0.789 0.603 0.839 0.645 CB 1.282 32 residues pruned to eliminate duplicates Z: 26 26.529 2.139 0.543 0.790 0.960 0.720 CB 1.298 26 residues pruned to eliminate duplicates Z: 24 31.071 2.179 0.805 0.789 0.957 0.696 CB 1.337 24 residues pruned to eliminate duplicates Z: 23 25.386 2.098 0.622 0.811 0.864 0.545 CB 1.404 23 residues pruned to eliminate duplicates Z: 26 29.688 2.130 0.907 0.756 0.880 0.720 CB 1.322 26 residues pruned to eliminate duplicates Z: 23 31.572 2.156 0.888 0.807 0.909 0.727 CB 1.391 23 residues pruned to eliminate duplicates Z: 22 33.995 2.250 0.792 0.856 0.952 0.619 CB 1.425 22 residues pruned to eliminate duplicates Z: 21 29.143 2.192 0.878 0.769 0.900 0.450 CB 1.386 21 residues pruned to eliminate duplicates Z: 27 25.695 2.157 0.985 0.743 0.885 0.692 CB 1.071 27 residues pruned to eliminate duplicates Z: 25 32.704 2.194 1.000 0.784 0.958 0.583 CB 1.236 25 residues pruned to eliminate duplicates Z: 23 38.173 2.213 1.188 0.824 0.955 0.636 CB 1.330 23 residues pruned to eliminate duplicates Z: 35 31.709 2.118 0.902 0.678 0.912 0.618 CB 1.257 35 residues pruned to eliminate duplicates Z: 24 29.842 2.101 0.991 0.782 0.913 0.435 CB 1.271 24 residues pruned to eliminate duplicates Z: 25 30.969 2.044 1.041 0.733 0.875 0.458 CB 1.404 25 residues pruned to eliminate duplicates Z: 29 36.491 2.088 1.069 0.710 0.929 0.643 CB 1.420 29 residues pruned to eliminate duplicates Z: 25 36.064 2.142 1.115 0.780 0.917 0.500 CB 1.385 25 residues pruned to eliminate duplicates Z: 24 38.209 2.142 1.277 0.790 0.957 0.478 CB 1.324 24 residues pruned to eliminate duplicates Z: 24 36.766 2.190 1.245 0.768 0.870 0.522 CB 1.414 24 residues pruned to eliminate duplicates Z: 6 5.033 1.796 0.035 0.479 1.000 1.000 N 1.238 Z: 7 4.787 1.681 -0.094 0.526 1.000 0.833 N 1.250 6 residues pruned to eliminate duplicates Z: 6 5.189 1.724 0.200 0.426 1.000 0.600 CB 1.211 6 residues pruned to eliminate duplicates Z: 7 3.799 1.694 0.060 0.357 0.833 0.500 N 1.209 7 residues pruned to eliminate duplicates Z: 41 32.464 2.249 0.461 0.574 0.925 0.600 CB 1.572 41 residues pruned to eliminate duplicates Z: 41 30.630 2.213 0.350 0.588 0.925 0.625 CB 1.611 42 residues pruned to eliminate duplicates Z: 8 5.056 1.686 0.254 0.440 1.000 0.571 CB 0.962 8 residues pruned to eliminate duplicates Z: 41 30.686 2.245 0.462 0.550 0.875 0.575 CB 1.608 41 residues pruned to eliminate duplicates Z: 40 29.881 2.267 0.381 0.535 0.897 0.564 CB 1.645 40 residues pruned to eliminate duplicates Z: 42 30.840 2.205 0.409 0.621 0.902 0.659 CB 1.533 42 residues pruned to eliminate duplicates Z: 37 30.717 2.264 0.488 0.556 0.861 0.528 CB 1.671 37 residues pruned to eliminate duplicates Z: 40 24.943 2.200 0.390 0.561 0.821 0.615 CB 1.501 40 residues pruned to eliminate duplicates Z: 24 29.729 2.338 0.328 0.755 0.913 0.696 CB 1.742 24 residues pruned to eliminate duplicates Z: 34 32.240 2.298 0.506 0.628 0.909 0.667 CB 1.582 34 residues pruned to eliminate duplicates Z: 37 30.223 2.164 0.519 0.608 0.889 0.750 CB 1.556 37 residues pruned to eliminate duplicates Z: 36 27.078 2.217 0.292 0.650 0.886 0.800 CB 1.568 36 residues pruned to eliminate duplicates Z: 37 27.172 2.168 0.615 0.533 0.778 0.556 CB 1.610 37 residues pruned to eliminate duplicates Z: 34 35.550 2.300 0.599 0.647 0.909 0.667 CB 1.614 34 residues pruned to eliminate duplicates Z: 33 38.143 2.260 0.628 0.700 0.906 0.719 CB 1.685 33 residues pruned to eliminate duplicates Z: 25 32.284 2.380 0.497 0.744 0.875 0.625 CB 1.699 25 residues pruned to eliminate duplicates Z: 48 32.660 2.219 0.657 0.539 0.830 0.596 CB 1.503 48 residues pruned to eliminate duplicates Z: 38 32.533 2.276 0.387 0.607 0.919 0.703 CB 1.665 38 residues pruned to eliminate duplicates Z: 34 29.136 2.212 0.472 0.574 0.909 0.636 CB 1.595 34 residues pruned to eliminate duplicates Z: 36 29.786 2.261 0.543 0.588 0.886 0.629 CB 1.498 36 residues pruned to eliminate duplicates Z: 25 31.310 2.359 0.446 0.737 0.875 0.750 CB 1.731 25 residues pruned to eliminate duplicates Z: 35 27.357 2.253 0.388 0.631 0.853 0.588 CB 1.555 35 residues pruned to eliminate duplicates Z: 36 32.651 2.283 0.519 0.611 0.857 0.714 CB 1.671 36 residues pruned to eliminate duplicates Z: 42 28.594 2.236 0.466 0.522 0.854 0.488 CB 1.561 42 residues pruned to eliminate duplicates Z: 35 32.922 2.258 0.637 0.616 0.853 0.706 CB 1.604 35 residues pruned to eliminate duplicates Z: 31 32.863 2.288 0.628 0.699 0.867 0.500 CB 1.550 31 residues pruned to eliminate duplicates Z: 36 27.241 2.223 0.429 0.580 0.800 0.629 CB 1.678 36 residues pruned to eliminate duplicates Z: 8 15.027 2.209 0.822 0.581 0.857 0.571 CB 1.523 8 residues pruned to eliminate duplicates Z: 10 11.504 2.093 0.725 0.390 0.889 0.444 CB 1.342 10 residues pruned to eliminate duplicates Z: 32 24.547 2.162 0.497 0.587 0.871 0.581 CB 1.439 32 residues pruned to eliminate duplicates Z: 39 27.640 2.139 0.450 0.516 0.868 0.553 CB 1.639 39 residues pruned to eliminate duplicates Z: 67 76.357 2.627 1.017 0.653 0.879 0.576 CB 1.751 67 residues pruned to eliminate duplicates Z: 10 12.324 2.271 0.375 0.560 0.889 0.778 CA 1.396 10 residues pruned to eliminate duplicates Z: 56 65.243 2.680 0.846 0.632 0.873 0.473 CB 1.800 56 residues pruned to eliminate duplicates Z: 18 15.533 2.272 0.487 0.437 0.824 0.412 CB 1.445 18 residues pruned to eliminate duplicates Z: 60 51.513 2.523 0.925 0.587 0.831 0.407 CB 1.529 60 residues pruned to eliminate duplicates Z: 66 73.357 2.618 0.869 0.660 0.908 0.492 CB 1.766 66 residues pruned to eliminate duplicates Z: 56 61.061 2.549 0.985 0.598 0.891 0.527 CA 1.662 56 residues pruned to eliminate duplicates Z: 21 16.671 2.295 0.525 0.512 0.850 0.500 CB 1.239 21 residues pruned to eliminate duplicates Z: 12 11.889 2.146 0.317 0.567 0.909 0.636 CB 1.307 12 residues pruned to eliminate duplicates Z: 69 63.175 2.562 0.931 0.606 0.838 0.515 CB 1.670 69 residues pruned to eliminate duplicates Z: 126 66.792 2.450 0.612 0.477 0.920 0.608 CB 1.683 259 residues pruned to eliminate duplicates Z: 7 7.137 1.954 0.270 0.343 1.000 0.833 CA 1.393 7 residues pruned to eliminate duplicates Z: 50 39.378 2.350 0.731 0.420 0.939 0.612 CB 1.600 50 residues pruned to eliminate duplicates Z: 25 15.321 2.108 0.554 0.352 0.833 0.458 CB 1.345 25 residues pruned to eliminate duplicates Z: 21 13.031 2.062 0.534 0.296 0.950 0.400 CB 1.218 21 residues pruned to eliminate duplicates Z: 53 36.440 2.303 0.666 0.405 0.923 0.673 CB 1.576 53 residues pruned to eliminate duplicates Z: 60 35.343 2.349 0.493 0.401 0.881 0.508 CB 1.652 60 residues pruned to eliminate duplicates Z: 53 31.076 2.275 0.627 0.385 0.865 0.577 CB 1.520 53 residues pruned to eliminate duplicates Z: 52 39.193 2.326 0.770 0.410 0.882 0.608 CB 1.662 52 residues pruned to eliminate duplicates Z: 52 37.166 2.367 0.627 0.398 0.902 0.549 CB 1.668 52 residues pruned to eliminate duplicates Z: 47 41.211 2.380 0.740 0.425 0.913 0.543 CB 1.737 47 residues pruned to eliminate duplicates Z: 52 37.769 2.346 0.633 0.416 0.941 0.529 CB 1.602 52 residues pruned to eliminate duplicates Z: 55 35.939 2.287 0.623 0.397 0.907 0.593 CB 1.619 55 residues pruned to eliminate duplicates Z: 87 52.947 2.429 0.566 0.470 0.930 0.605 CB 1.663 87 residues pruned to eliminate duplicates Z: 98 59.286 2.440 0.597 0.442 0.938 0.608 CB 1.749 98 residues pruned to eliminate duplicates Z: 98 55.729 2.451 0.610 0.423 0.907 0.588 CB 1.712 98 residues pruned to eliminate duplicates Z: 96 58.073 2.475 0.638 0.455 0.895 0.611 CB 1.719 96 residues pruned to eliminate duplicates Z: 93 61.665 2.466 0.716 0.475 0.924 0.598 CB 1.686 93 residues pruned to eliminate duplicates Z: 95 54.505 2.437 0.557 0.450 0.894 0.617 CB 1.746 95 residues pruned to eliminate duplicates Z: 38 24.639 2.315 0.649 0.303 0.892 0.541 CB 1.481 38 residues pruned to eliminate duplicates Z: 50 35.894 2.359 0.604 0.416 0.898 0.633 CB 1.647 50 residues pruned to eliminate duplicates Z: 53 35.813 2.307 0.608 0.420 0.923 0.635 CB 1.576 53 residues pruned to eliminate duplicates Z: 105 57.953 2.402 0.657 0.417 0.933 0.644 CB 1.671 121 residues pruned to eliminate duplicates Z: 9 12.938 2.046 0.836 0.449 0.875 0.500 CB 1.466 9 residues pruned to eliminate duplicates Z: 96 61.759 2.498 0.635 0.447 0.926 0.611 CB 1.769 96 residues pruned to eliminate duplicates Z: 53 33.986 2.322 0.511 0.383 0.923 0.577 CB 1.649 53 residues pruned to eliminate duplicates Z: 51 35.186 2.325 0.551 0.389 0.940 0.620 CB 1.651 51 residues pruned to eliminate duplicates Z: 75 61.775 2.558 0.630 0.497 0.959 0.595 CB 1.800 75 residues pruned to eliminate duplicates Z: 43 35.839 2.367 0.580 0.450 0.905 0.690 CB 1.720 43 residues pruned to eliminate duplicates Z: 52 27.371 2.256 0.424 0.402 0.843 0.471 CB 1.568 52 residues pruned to eliminate duplicates Z: 53 34.340 2.295 0.547 0.394 0.923 0.558 CB 1.625 53 residues pruned to eliminate duplicates Z: 52 35.568 2.333 0.565 0.429 0.882 0.608 CB 1.665 52 residues pruned to eliminate duplicates Z: 50 37.791 2.379 0.607 0.425 0.939 0.592 CB 1.626 50 residues pruned to eliminate duplicates Z: 93 62.684 2.508 0.605 0.451 0.957 0.620 CB 1.784 93 residues pruned to eliminate duplicates Z: 52 35.969 2.332 0.543 0.428 0.902 0.588 CB 1.671 52 residues pruned to eliminate duplicates Z: 60 56.231 2.481 0.667 0.551 0.932 0.542 CB 1.806 60 residues pruned to eliminate duplicates Z: 57 52.522 2.544 0.611 0.514 0.911 0.643 CB 1.855 57 residues pruned to eliminate duplicates Z: 93 62.147 2.487 0.703 0.460 0.924 0.609 CB 1.724 93 residues pruned to eliminate duplicates Z: 98 55.878 2.442 0.605 0.420 0.897 0.649 CB 1.753 98 residues pruned to eliminate duplicates Z: 59 56.020 2.559 0.611 0.526 0.948 0.603 CA 1.835 59 residues pruned to eliminate duplicates Z: 99 58.611 2.455 0.574 0.456 0.929 0.582 CB 1.726 99 residues pruned to eliminate duplicates Z: 99 57.558 2.451 0.553 0.442 0.929 0.612 CB 1.747 99 residues pruned to eliminate duplicates Z: 65 46.243 2.434 0.515 0.514 0.891 0.578 CB 1.736 65 residues pruned to eliminate duplicates Z: 97 60.576 2.477 0.552 0.451 0.948 0.604 CB 1.785 97 residues pruned to eliminate duplicates Z: 107 64.631 2.460 0.625 0.476 0.925 0.632 CB 1.740 127 residues pruned to eliminate duplicates Z: 97 64.645 2.491 0.677 0.460 0.938 0.635 CB 1.756 97 residues pruned to eliminate duplicates Z: 97 61.798 2.473 0.557 0.463 0.948 0.594 CB 1.794 97 residues pruned to eliminate duplicates Z: 98 55.045 2.438 0.539 0.474 0.907 0.608 CB 1.686 98 residues pruned to eliminate duplicates Z: 97 61.018 2.487 0.651 0.445 0.927 0.646 CB 1.730 97 residues pruned to eliminate duplicates Z: 67 50.564 2.487 0.563 0.497 0.909 0.636 CB 1.765 67 residues pruned to eliminate duplicates Z: 84 56.487 2.479 0.677 0.427 0.928 0.663 CB 1.734 84 residues pruned to eliminate duplicates Z: 38 36.296 2.536 0.614 0.435 0.865 0.405 CB 1.801 38 residues pruned to eliminate duplicates Z: 92 62.596 2.518 0.623 0.444 0.956 0.571 CB 1.780 92 residues pruned to eliminate duplicates Z: 38 38.403 2.536 0.555 0.432 0.919 0.541 CA 1.869 38 residues pruned to eliminate duplicates Z: 102 52.441 2.424 0.513 0.447 0.891 0.663 CB 1.686 102 residues pruned to eliminate duplicates Z: 71 60.240 2.580 0.639 0.472 0.943 0.600 CB 1.858 71 residues pruned to eliminate duplicates Z: 100 62.204 2.467 0.603 0.452 0.949 0.667 CB 1.749 100 residues pruned to eliminate duplicates Z: 92 60.840 2.495 0.649 0.446 0.934 0.604 CB 1.753 92 residues pruned to eliminate duplicates Z: 33 36.992 2.705 0.471 0.425 0.906 0.562 CB 1.960 33 residues pruned to eliminate duplicates Z: 36 35.209 2.620 0.569 0.439 0.886 0.514 CB 1.741 36 residues pruned to eliminate duplicates Z: 33 39.790 2.696 0.552 0.447 0.969 0.562 CA 1.833 33 residues pruned to eliminate duplicates Z: 33 36.903 2.678 0.596 0.424 0.875 0.625 CB 1.887 33 residues pruned to eliminate duplicates Z: 33 37.743 2.742 0.480 0.439 0.938 0.500 CB 1.868 33 residues pruned to eliminate duplicates Z: 93 60.018 2.500 0.620 0.435 0.957 0.587 CB 1.727 93 residues pruned to eliminate duplicates Z: 56 56.039 2.580 0.724 0.529 0.909 0.564 CB 1.815 56 residues pruned to eliminate duplicates Z: 93 54.952 2.467 0.608 0.438 0.880 0.598 CB 1.749 93 residues pruned to eliminate duplicates Z: 90 61.294 2.529 0.578 0.458 0.944 0.607 CB 1.801 90 residues pruned to eliminate duplicates Z: 33 36.819 2.747 0.585 0.453 0.812 0.562 CB 1.932 33 residues pruned to eliminate duplicates Z: 34 34.357 2.669 0.527 0.411 0.879 0.636 CB 1.834 34 residues pruned to eliminate duplicates Z: 30 16.637 2.186 0.507 0.297 0.828 0.379 CB 1.423 30 residues pruned to eliminate duplicates Z: 94 62.081 2.507 0.587 0.464 0.957 0.613 CB 1.753 94 residues pruned to eliminate duplicates Z: 57 53.725 2.566 0.604 0.543 0.911 0.661 CB 1.836 57 residues pruned to eliminate duplicates Z: 96 60.178 2.492 0.637 0.455 0.916 0.642 CB 1.730 96 residues pruned to eliminate duplicates Z: 32 40.719 2.766 0.640 0.417 0.935 0.484 CB 1.880 32 residues pruned to eliminate duplicates Z: 11 11.979 2.655 0.267 0.417 0.800 0.400 CB 1.535 11 residues pruned to eliminate duplicates Z: 33 40.957 2.722 0.558 0.448 0.969 0.469 CB 1.858 33 residues pruned to eliminate duplicates Z: 15 9.930 2.334 0.168 0.254 0.857 0.214 CB 1.507 15 residues pruned to eliminate duplicates Z: 34 40.054 2.672 0.636 0.448 0.939 0.424 CB 1.790 34 residues pruned to eliminate duplicates Z: 100 74.958 2.643 0.651 0.575 0.909 0.636 CA 1.767 100 residues pruned to eliminate duplicates Z: 95 58.684 2.497 0.646 0.442 0.894 0.564 CB 1.749 95 residues pruned to eliminate duplicates Z: 98 47.691 2.417 0.456 0.429 0.897 0.536 CB 1.652 98 residues pruned to eliminate duplicates Z: 96 58.432 2.491 0.599 0.442 0.926 0.537 CB 1.726 96 residues pruned to eliminate duplicates Z: 68 53.728 2.605 0.647 0.636 0.836 0.627 CA 1.611 Z: 12 25.590 2.522 0.511 0.822 0.909 0.727 CB 1.685 12 residues pruned to eliminate duplicates Z: 69 65.270 2.604 0.735 0.628 0.868 0.618 CB 1.791 69 residues pruned to eliminate duplicates Z: 10 20.605 2.470 0.491 0.858 0.889 0.667 CA 1.545 10 residues pruned to eliminate duplicates Z: 10 22.055 2.553 0.580 0.800 0.889 0.556 CA 1.577 10 residues pruned to eliminate duplicates Z: 9 25.655 2.562 0.614 0.784 1.000 0.625 CB 1.708 11 residues pruned to eliminate duplicates Z: 14 18.093 2.341 0.582 0.736 0.769 0.692 CB 1.426 14 residues pruned to eliminate duplicates Z: 56 73.139 2.711 0.891 0.675 0.945 0.673 CA 1.731 58 residues pruned to eliminate duplicates Z: 11 22.499 2.496 0.584 0.857 0.900 0.900 CB 1.474 11 residues pruned to eliminate duplicates Z: 55 64.204 2.639 0.793 0.650 0.926 0.667 CA 1.734 119 residues pruned to eliminate duplicates Z: 57 69.617 2.719 0.852 0.670 0.911 0.679 CA 1.734 Z: 13 21.858 2.398 0.470 0.743 0.917 0.750 CA 1.571 13 residues pruned to eliminate duplicates Z: 57 66.591 2.702 0.855 0.680 0.839 0.643 CA 1.794 57 residues pruned to eliminate duplicates Z: 48 54.646 2.685 0.858 0.627 0.830 0.596 CA 1.709 48 residues pruned to eliminate duplicates Z: 48 74.849 2.711 1.059 0.734 0.936 0.702 CA 1.693 46 residues pruned to eliminate duplicates Z: 26 53.315 2.772 0.630 0.851 1.000 0.960 CA 1.747 26 residues pruned to eliminate duplicates Z: 73 71.769 2.619 0.757 0.627 0.889 0.625 CB 1.834 59 residues pruned to eliminate duplicates Z: 23 45.635 2.841 0.600 0.905 1.000 0.818 CA 1.523 23 residues pruned to eliminate duplicates Z: 49 55.919 2.566 0.962 0.543 0.854 0.562 CA 1.800 49 residues pruned to eliminate duplicates Z: 66 64.890 2.629 0.684 0.640 0.892 0.646 CA 1.787 66 residues pruned to eliminate duplicates Z: 69 67.530 2.603 0.784 0.615 0.882 0.618 CA 1.793 69 residues pruned to eliminate duplicates Z: 59 71.110 2.668 0.844 0.656 0.914 0.690 CA 1.798 58 residues pruned to eliminate duplicates Z: 26 56.998 2.752 0.923 0.912 0.960 0.800 CA 1.589 26 residues pruned to eliminate duplicates Z: 56 72.128 2.668 0.950 0.658 0.945 0.636 CA 1.707 58 residues pruned to eliminate duplicates Z: 23 68.376 2.885 1.129 0.934 1.000 0.818 CA 1.655 23 residues pruned to eliminate duplicates Z: 57 75.550 2.696 0.876 0.700 0.911 0.554 CA 1.827 57 residues pruned to eliminate duplicates Z: 62 71.584 2.644 0.853 0.653 0.934 0.639 CA 1.737 62 residues pruned to eliminate duplicates Z: 53 61.306 2.603 0.924 0.678 0.885 0.712 CA 1.628 53 residues pruned to eliminate duplicates Z: 66 83.850 2.634 1.041 0.667 0.938 0.646 CA 1.766 74 residues pruned to eliminate duplicates Z: 24 66.865 2.778 1.149 0.924 0.957 0.565 CA 1.715 24 residues pruned to eliminate duplicates Z: 75 67.499 2.496 0.953 0.590 0.851 0.581 CA 1.735 75 residues pruned to eliminate duplicates Z: 54 77.172 2.603 1.065 0.675 0.925 0.491 CB 1.815 54 residues pruned to eliminate duplicates Z: 68 73.525 2.611 0.953 0.654 0.851 0.507 CB 1.794 68 residues pruned to eliminate duplicates Z: 62 64.344 2.589 0.999 0.642 0.820 0.443 CB 1.700 62 residues pruned to eliminate duplicates Z: 161 92.049 2.553 0.715 0.523 0.913 0.575 CB 1.782 225 residues pruned to eliminate duplicates Z: 41 66.073 2.645 1.042 0.677 0.875 0.450 CA 1.879 Z: 25 57.281 2.743 1.180 0.851 0.875 0.583 CA 1.655 23 residues pruned to eliminate duplicates Z: 28 45.579 2.674 1.207 0.786 0.667 0.407 CA 1.734 28 residues pruned to eliminate duplicates Z: 23 52.893 2.577 1.348 0.764 0.818 0.318 CB 1.801 23 residues pruned to eliminate duplicates Z: 56 58.161 2.537 0.919 0.569 0.855 0.564 CA 1.763 56 residues pruned to eliminate duplicates Z: 63 68.301 2.583 1.039 0.600 0.855 0.452 CB 1.752 51 residues pruned to eliminate duplicates Z: 9 26.199 2.562 1.102 0.729 0.875 0.500 CB 1.600 10 residues pruned to eliminate duplicates Z: 10 30.350 2.506 1.170 0.785 1.000 0.444 CB 1.448 9 residues pruned to eliminate duplicates Z: 9 34.547 2.409 1.247 0.885 1.000 0.500 CB 1.630 9 residues pruned to eliminate duplicates Z: 23 18.192 2.385 0.463 0.479 0.818 0.318 CB 1.387 10 residues pruned to eliminate duplicates Z: 10 15.129 2.223 1.203 0.718 0.667 0.556 CB 1.268 10 residues pruned to eliminate duplicates Z: 13 19.779 2.471 0.869 0.455 0.833 0.167 CB 1.554 13 residues pruned to eliminate duplicates Z: 73 72.122 2.612 0.882 0.632 0.903 0.458 CB 1.692 69 residues pruned to eliminate duplicates Z: 10 16.224 2.282 0.893 0.697 0.667 0.333 CB 1.569 10 residues pruned to eliminate duplicates Z: 75 70.690 2.594 0.854 0.608 0.865 0.500 CB 1.782 75 residues pruned to eliminate duplicates Z: 44 29.206 2.408 0.477 0.447 0.791 0.419 CB 1.672 56 residues pruned to eliminate duplicates Z: 6 10.416 2.292 0.328 0.456 0.800 0.400 CA 2.000 6 residues pruned to eliminate duplicates Z: 25 14.489 2.263 0.133 0.341 0.875 0.500 CB 1.568 25 residues pruned to eliminate duplicates Z: 17 15.843 2.297 0.346 0.405 0.938 0.375 CB 1.510 17 residues pruned to eliminate duplicates Z: 61 42.036 2.261 0.585 0.515 0.850 0.567 CB 1.756 159 residues pruned to eliminate duplicates Z: 44 44.787 2.421 0.693 0.537 0.860 0.512 CB 1.867 23 residues pruned to eliminate duplicates Z: 6 6.019 1.782 0.617 0.386 1.000 0.800 CA 1.054 6 residues pruned to eliminate duplicates Z: 24 19.597 2.253 0.419 0.446 0.913 0.652 CB 1.480 23 residues pruned to eliminate duplicates Z: 7 7.717 2.026 0.531 0.456 0.833 0.833 CA 1.275 7 residues pruned to eliminate duplicates Z: 13 17.886 2.449 0.190 0.542 0.917 0.500 CA 1.855 13 residues pruned to eliminate duplicates Z: 23 21.324 2.376 0.320 0.425 0.909 0.500 CB 1.723 23 residues pruned to eliminate duplicates Z: 6 2.560 1.504 0.631 0.440 0.800 0.200 N 0.620 6 residues pruned to eliminate duplicates Z: 42 32.122 2.297 0.428 0.545 0.854 0.537 CA 1.714 42 residues pruned to eliminate duplicates Z: 52 39.849 2.319 0.618 0.549 0.902 0.471 CB 1.571 52 residues pruned to eliminate duplicates Z: 21 34.049 2.358 0.586 0.784 0.900 0.900 CA 1.762 Z: 19 36.541 2.416 0.598 0.905 1.000 0.778 CA 1.587 21 residues pruned to eliminate duplicates Z: 20 41.222 2.335 0.823 0.876 0.947 0.684 CA 1.704 20 residues pruned to eliminate duplicates Z: 18 43.973 2.427 0.889 0.912 0.941 0.824 CA 1.750 18 residues pruned to eliminate duplicates Z: 29 29.994 2.265 0.621 0.590 0.857 0.536 CB 1.652 29 residues pruned to eliminate duplicates Z: 19 42.700 2.418 0.678 0.914 1.000 0.778 CA 1.754 19 residues pruned to eliminate duplicates Z: 42 35.486 2.261 0.466 0.643 0.927 0.659 CB 1.580 44 residues pruned to eliminate duplicates Z: 18 46.556 2.419 0.812 0.934 1.000 0.765 CA 1.796 18 residues pruned to eliminate duplicates Z: 21 45.495 2.391 0.914 0.825 0.950 0.500 CA 1.765 21 residues pruned to eliminate duplicates Z: 61 40.195 2.349 0.758 0.514 0.867 0.433 CB 1.430 50 residues pruned to eliminate duplicates Z: 15 28.072 2.105 1.189 0.827 0.857 0.357 CA 1.432 15 residues pruned to eliminate duplicates Z: 21 47.652 2.338 1.201 0.799 0.950 0.500 CB 1.678 22 residues pruned to eliminate duplicates Z: 20 33.518 2.248 0.919 0.903 0.789 0.316 CB 1.610 20 residues pruned to eliminate duplicates Z: 19 43.648 2.485 1.078 0.813 0.833 0.444 CB 1.821 19 residues pruned to eliminate duplicates Z: 21 39.832 2.338 1.019 0.764 0.850 0.550 CB 1.756 21 residues pruned to eliminate duplicates Z: 19 45.885 2.375 1.009 0.929 0.944 0.611 CB 1.680 19 residues pruned to eliminate duplicates Z: 24 28.176 2.197 0.911 0.687 0.783 0.435 CB 1.507 24 residues pruned to eliminate duplicates Z: 72 38.776 2.395 0.429 0.460 0.930 0.690 CB 1.507 72 residues pruned to eliminate duplicates Z: 65 47.217 2.480 0.599 0.460 0.938 0.594 CB 1.654 65 residues pruned to eliminate duplicates Z: 66 44.942 2.466 0.560 0.446 0.938 0.662 CB 1.632 66 residues pruned to eliminate duplicates Z: 89 42.776 2.376 0.504 0.432 0.875 0.580 CB 1.564 89 residues pruned to eliminate duplicates Z: 119 71.271 2.521 0.582 0.527 0.932 0.636 CB 1.718 119 residues pruned to eliminate duplicates Z: 211 116.319 2.566 0.792 0.576 0.914 0.614 CA 1.774 232 residues pruned to eliminate duplicates Z: 66 44.245 2.452 0.541 0.451 0.954 0.585 CB 1.600 66 residues pruned to eliminate duplicates Z: 54 38.423 2.462 0.504 0.433 0.925 0.604 CB 1.653 54 residues pruned to eliminate duplicates Z: 220 117.365 2.581 0.809 0.533 0.936 0.584 CA 1.757 220 residues pruned to eliminate duplicates Z: 67 39.041 2.430 0.598 0.417 0.864 0.576 CB 1.562 67 residues pruned to eliminate duplicates Z: 80 48.893 2.459 0.505 0.506 0.924 0.646 CB 1.599 80 residues pruned to eliminate duplicates Z: 63 40.943 2.476 0.486 0.443 0.935 0.677 CB 1.602 63 residues pruned to eliminate duplicates Z: 65 40.846 2.449 0.526 0.460 0.906 0.688 CB 1.570 65 residues pruned to eliminate duplicates Z: 200 115.557 2.578 0.864 0.575 0.905 0.633 CB 1.753 200 residues pruned to eliminate duplicates Z: 196 113.740 2.595 0.877 0.555 0.903 0.610 CB 1.757 196 residues pruned to eliminate duplicates Z: 50 38.408 2.421 0.627 0.443 0.857 0.551 CB 1.724 50 residues pruned to eliminate duplicates Z: 15 23.001 2.392 0.423 0.554 1.000 0.571 CB 1.713 15 residues pruned to eliminate duplicates Z: 77 46.920 2.456 0.562 0.414 0.934 0.632 CB 1.643 77 residues pruned to eliminate duplicates Z: 65 48.773 2.473 0.607 0.456 0.953 0.641 CB 1.683 65 residues pruned to eliminate duplicates Z: 67 43.843 2.437 0.574 0.465 0.939 0.621 CB 1.552 67 residues pruned to eliminate duplicates Z: 195 112.000 2.584 0.811 0.557 0.912 0.649 CB 1.782 195 residues pruned to eliminate duplicates Z: 14 15.198 2.272 0.477 0.488 0.923 0.462 CB 1.376 14 residues pruned to eliminate duplicates Z: 55 44.429 2.504 0.633 0.478 0.926 0.611 CB 1.633 55 residues pruned to eliminate duplicates Z: 52 41.960 2.445 0.689 0.486 0.902 0.588 CB 1.600 52 residues pruned to eliminate duplicates Z: 85 53.603 2.522 0.605 0.449 0.929 0.655 CB 1.639 85 residues pruned to eliminate duplicates Z: 85 57.931 2.551 0.643 0.448 0.952 0.560 CB 1.671 85 residues pruned to eliminate duplicates Z: 120 50.993 2.413 0.607 0.417 0.874 0.546 CB 1.504 120 residues pruned to eliminate duplicates Z: 88 52.141 2.512 0.591 0.413 0.943 0.598 CB 1.625 88 residues pruned to eliminate duplicates Z: 102 58.999 2.479 0.641 0.463 0.950 0.624 CB 1.577 102 residues pruned to eliminate duplicates Z: 102 55.895 2.478 0.645 0.443 0.911 0.634 CB 1.589 102 residues pruned to eliminate duplicates Z: 99 57.265 2.498 0.701 0.448 0.908 0.622 CB 1.581 99 residues pruned to eliminate duplicates Z: 101 58.706 2.494 0.692 0.443 0.920 0.620 CB 1.602 101 residues pruned to eliminate duplicates Z: 93 57.952 2.551 0.623 0.442 0.924 0.576 CB 1.677 93 residues pruned to eliminate duplicates Z: 99 57.438 2.511 0.613 0.449 0.929 0.612 CB 1.626 99 residues pruned to eliminate duplicates Z: 105 60.769 2.466 0.678 0.460 0.923 0.596 CB 1.626 105 residues pruned to eliminate duplicates Z: 99 58.155 2.517 0.622 0.444 0.929 0.602 CB 1.641 99 residues pruned to eliminate duplicates Z: 70 57.721 2.582 0.646 0.483 0.957 0.594 CB 1.739 70 residues pruned to eliminate duplicates Z: 79 54.027 2.491 0.694 0.448 0.936 0.551 CB 1.634 79 residues pruned to eliminate duplicates Z: 33 32.390 2.541 0.667 0.401 0.969 0.531 CA 1.549 33 residues pruned to eliminate duplicates Z: 96 64.288 2.522 0.761 0.436 0.958 0.568 CB 1.656 96 residues pruned to eliminate duplicates Z: 32 28.463 2.588 0.537 0.428 0.871 0.548 CB 1.590 32 residues pruned to eliminate duplicates Z: 102 60.128 2.521 0.693 0.451 0.931 0.574 CB 1.583 102 residues pruned to eliminate duplicates Z: 36 32.717 2.554 0.653 0.370 0.886 0.457 CB 1.700 49 residues pruned to eliminate duplicates Z: 14 9.381 2.168 0.407 0.326 0.923 0.308 CA 1.118 14 residues pruned to eliminate duplicates Z: 96 59.729 2.542 0.680 0.435 0.937 0.547 CB 1.639 96 residues pruned to eliminate duplicates Z: 91 55.781 2.500 0.650 0.486 0.900 0.544 CB 1.606 91 residues pruned to eliminate duplicates Z: 182 86.975 2.517 0.671 0.490 0.923 0.613 CB 1.683 182 residues pruned to eliminate duplicates Z: 168 91.383 2.610 0.653 0.585 0.916 0.635 CA 1.648 168 residues pruned to eliminate duplicates Z: 38 38.744 2.627 0.643 0.410 0.946 0.459 CB 1.715 38 residues pruned to eliminate duplicates Z: 96 54.469 2.523 0.575 0.441 0.905 0.579 CB 1.650 96 residues pruned to eliminate duplicates Z: 47 44.837 2.534 0.628 0.465 0.957 0.522 CA 1.736 47 residues pruned to eliminate duplicates Z: 9 5.117 2.130 0.015 0.167 1.000 0.500 CB 1.254 9 residues pruned to eliminate duplicates Z: 35 35.226 2.534 0.584 0.436 0.971 0.647 CB 1.658 35 residues pruned to eliminate duplicates Z: 84 59.497 2.661 0.605 0.559 0.904 0.627 CA 1.597 54 residues pruned to eliminate duplicates Z: 14 29.132 2.387 0.863 0.716 0.923 0.769 CA 1.618 14 residues pruned to eliminate duplicates Z: 140 90.354 2.618 0.722 0.606 0.921 0.683 CA 1.670 140 residues pruned to eliminate duplicates Z: 133 93.592 2.645 0.846 0.598 0.886 0.689 CA 1.714 133 residues pruned to eliminate duplicates Z: 19 24.271 2.404 0.776 0.511 0.944 0.556 CA 1.403 19 residues pruned to eliminate duplicates Z: 194 110.672 2.618 0.674 0.595 0.922 0.668 CA 1.798 194 residues pruned to eliminate duplicates Z: 18 28.473 2.472 0.949 0.600 0.824 0.588 CA 1.582 18 residues pruned to eliminate duplicates Z: 14 32.067 2.244 1.186 0.694 0.923 0.615 CB 1.645 14 residues pruned to eliminate duplicates Z: 23 30.091 2.463 0.844 0.531 0.864 0.636 CB 1.587 23 residues pruned to eliminate duplicates Z: 28 47.375 2.620 0.950 0.654 0.963 0.630 CA 1.606 28 residues pruned to eliminate duplicates Z: 21 31.537 2.557 0.903 0.657 0.900 0.550 CA 1.391 21 residues pruned to eliminate duplicates Z: 65 54.879 2.575 0.761 0.498 0.922 0.500 CA 1.645 65 residues pruned to eliminate duplicates Z: 84 77.635 2.687 0.864 0.582 0.940 0.687 CA 1.672 93 residues pruned to eliminate duplicates Z: 52 62.176 2.742 0.837 0.691 0.922 0.627 CA 1.575 52 residues pruned to eliminate duplicates Z: 6 7.869 1.976 0.638 0.429 0.800 0.200 CB 1.463 6 residues pruned to eliminate duplicates Z: 134 102.212 2.645 0.814 0.640 0.925 0.692 CA 1.753 134 residues pruned to eliminate duplicates Z: 50 55.929 2.654 0.745 0.639 0.878 0.633 CA 1.726 50 residues pruned to eliminate duplicates Z: 52 70.358 2.756 0.874 0.695 0.961 0.706 CA 1.662 52 residues pruned to eliminate duplicates Z: 50 56.489 2.620 0.955 0.674 0.857 0.653 CA 1.565 50 residues pruned to eliminate duplicates Z: 166 104.588 2.643 0.826 0.585 0.903 0.697 CA 1.722 166 residues pruned to eliminate duplicates Z: 37 61.387 2.882 0.756 0.726 0.972 0.833 CA 1.697 37 residues pruned to eliminate duplicates Z: 132 106.336 2.675 0.849 0.637 0.924 0.664 CA 1.789 132 residues pruned to eliminate duplicates Z: 93 64.374 2.521 0.702 0.526 0.913 0.620 CB 1.670 93 residues pruned to eliminate duplicates Z: 51 66.660 2.742 0.898 0.677 0.940 0.740 CA 1.637 51 residues pruned to eliminate duplicates Z: 26 45.682 2.648 0.779 0.889 1.000 0.880 CA 1.397 26 residues pruned to eliminate duplicates Z: 31 51.645 2.757 1.004 0.749 0.900 0.733 CA 1.518 31 residues pruned to eliminate duplicates Z: 49 64.172 2.740 0.832 0.717 0.917 0.667 CA 1.654 49 residues pruned to eliminate duplicates Z: 130 97.995 2.693 0.763 0.649 0.907 0.705 CA 1.744 130 residues pruned to eliminate duplicates Z: 125 107.453 2.691 0.903 0.628 0.935 0.677 CA 1.786 125 residues pruned to eliminate duplicates Z: 137 109.235 2.657 0.932 0.624 0.912 0.654 CA 1.780 137 residues pruned to eliminate duplicates Z: 115 94.662 2.674 0.898 0.537 0.939 0.561 CA 1.794 89 residues pruned to eliminate duplicates Z: 27 46.864 2.682 0.986 0.850 0.923 0.615 CA 1.384 27 residues pruned to eliminate duplicates Z: 54 67.647 2.725 0.797 0.668 0.943 0.660 CA 1.723 54 residues pruned to eliminate duplicates Z: 40 64.926 2.750 1.057 0.692 0.923 0.513 CA 1.671 40 residues pruned to eliminate duplicates Z: 49 72.440 2.778 0.990 0.716 0.958 0.688 CA 1.623 49 residues pruned to eliminate duplicates Z: 77 72.512 2.715 0.914 0.550 0.868 0.553 CA 1.755 77 residues pruned to eliminate duplicates Z: 84 77.074 2.706 0.789 0.571 0.940 0.627 CA 1.736 84 residues pruned to eliminate duplicates Z: 36 74.342 2.867 0.932 0.741 1.000 0.714 CA 1.827 36 residues pruned to eliminate duplicates Z: 57 73.551 2.630 1.061 0.625 0.929 0.464 CA 1.736 57 residues pruned to eliminate duplicates Z: 60 89.594 2.796 1.229 0.665 0.915 0.593 CA 1.756 60 residues pruned to eliminate duplicates Z: 121 109.217 2.658 0.951 0.638 0.925 0.658 CA 1.827 65 residues pruned to eliminate duplicates Z: 8 12.640 2.281 0.930 0.378 0.857 0.429 CA 1.443 Z: 6 9.639 2.153 0.571 0.425 1.000 0.600 CA 1.378 Z: 79 92.401 2.705 1.139 0.623 0.885 0.564 CA 1.821 93 residues pruned to eliminate duplicates Z: 121 103.048 2.664 0.942 0.626 0.900 0.650 CA 1.795 122 residues pruned to eliminate duplicates Z: 12 24.085 2.312 1.186 0.566 0.909 0.545 CA 1.482 12 residues pruned to eliminate duplicates Z: 145 112.433 2.635 0.927 0.634 0.903 0.688 CA 1.803 145 residues pruned to eliminate duplicates Z: 79 87.715 2.725 1.091 0.604 0.872 0.577 CA 1.811 79 residues pruned to eliminate duplicates Z: 88 91.017 2.649 0.992 0.586 0.920 0.540 CA 1.851 88 residues pruned to eliminate duplicates Z: 68 90.546 2.731 1.121 0.596 0.925 0.552 CA 1.883 68 residues pruned to eliminate duplicates Z: 78 88.837 2.737 1.127 0.613 0.896 0.649 CA 1.744 78 residues pruned to eliminate duplicates Z: 197 120.639 2.594 0.862 0.584 0.913 0.648 CB 1.802 197 residues pruned to eliminate duplicates Z: 120 98.570 2.662 0.820 0.631 0.924 0.622 CA 1.785 120 residues pruned to eliminate duplicates Z: 113 94.898 2.670 0.857 0.626 0.902 0.714 CA 1.782 113 residues pruned to eliminate duplicates Z: 177 102.585 2.600 0.855 0.537 0.892 0.562 CB 1.733 177 residues pruned to eliminate duplicates Z: 62 99.200 2.813 1.149 0.640 0.951 0.574 CA 1.938 62 residues pruned to eliminate duplicates Z: 85 75.977 2.602 0.788 0.607 0.881 0.702 CA 1.826 85 residues pruned to eliminate duplicates Z: 8 37.643 2.724 1.427 0.776 1.000 0.571 CA 1.687 8 residues pruned to eliminate duplicates Z: 130 103.639 2.641 0.932 0.604 0.907 0.566 CA 1.785 130 residues pruned to eliminate duplicates Z: 75 84.819 2.762 1.018 0.623 0.905 0.581 CA 1.740 75 residues pruned to eliminate duplicates Z: 130 103.874 2.632 0.874 0.624 0.922 0.620 CA 1.789 130 residues pruned to eliminate duplicates Z: 39 44.035 2.591 0.861 0.471 0.868 0.447 CA 1.757 39 residues pruned to eliminate duplicates Z: 88 92.087 2.688 1.097 0.589 0.897 0.586 CA 1.795 88 residues pruned to eliminate duplicates Z: 89 93.071 2.640 1.149 0.590 0.886 0.534 CA 1.811 89 residues pruned to eliminate duplicates Z: 75 96.473 2.740 1.191 0.616 0.919 0.541 CA 1.822 75 residues pruned to eliminate duplicates Z: 78 100.348 2.707 1.246 0.611 0.922 0.506 CA 1.836 78 residues pruned to eliminate duplicates Z: 88 75.059 2.559 0.794 0.583 0.920 0.667 CA 1.761 88 residues pruned to eliminate duplicates Z: 197 114.789 2.585 0.848 0.585 0.893 0.617 CB 1.772 131 residues pruned to eliminate duplicates Z: 7 15.112 2.099 0.889 0.543 1.000 0.500 CB 1.493 Z: 7 6.429 1.927 0.269 0.464 1.000 0.167 CB 1.114 7 residues pruned to eliminate duplicates Z: 70 78.827 2.749 1.009 0.569 0.913 0.551 CA 1.761 77 residues pruned to eliminate duplicates Z: 61 58.248 2.517 0.717 0.631 0.883 0.767 CA 1.741 61 residues pruned to eliminate duplicates Z: 138 104.306 2.646 0.822 0.621 0.927 0.664 CA 1.779 138 residues pruned to eliminate duplicates Z: 134 110.165 2.677 0.972 0.623 0.910 0.669 CA 1.770 134 residues pruned to eliminate duplicates Z: 57 45.177 2.468 0.541 0.571 0.911 0.643 CA 1.628 57 residues pruned to eliminate duplicates Z: 141 94.446 2.604 0.839 0.556 0.914 0.614 CA 1.727 141 residues pruned to eliminate duplicates Z: 60 61.544 2.520 0.772 0.639 0.915 0.678 CA 1.721 60 residues pruned to eliminate duplicates Z: 219 119.402 2.607 0.773 0.563 0.917 0.674 CB 1.793 219 residues pruned to eliminate duplicates Z: 86 68.857 2.587 0.749 0.582 0.894 0.659 CA 1.706 86 residues pruned to eliminate duplicates Z: 86 73.156 2.573 0.851 0.587 0.906 0.682 CA 1.692 86 residues pruned to eliminate duplicates Z: 124 71.309 2.470 0.593 0.555 0.927 0.715 CB 1.671 124 residues pruned to eliminate duplicates Z: 119 105.175 2.665 0.980 0.602 0.915 0.669 CA 1.820 119 residues pruned to eliminate duplicates Z: 152 87.079 2.506 0.722 0.531 0.914 0.609 CB 1.743 151 residues pruned to eliminate duplicates Z: 20 40.277 2.483 0.862 0.865 1.000 0.842 CA 1.465 20 residues pruned to eliminate duplicates Z: 192 112.286 2.558 0.847 0.566 0.906 0.644 CB 1.781 192 residues pruned to eliminate duplicates Z: 59 64.368 2.518 0.821 0.630 0.931 0.707 CA 1.753 59 residues pruned to eliminate duplicates Z: 84 73.383 2.601 0.706 0.608 0.940 0.639 CA 1.743 84 residues pruned to eliminate duplicates Z: 85 76.012 2.610 0.756 0.596 0.917 0.679 CA 1.801 85 residues pruned to eliminate duplicates Z: 136 113.331 2.653 1.002 0.620 0.926 0.637 CA 1.771 136 residues pruned to eliminate duplicates Z: 62 61.177 2.491 0.737 0.631 0.951 0.672 CA 1.684 62 residues pruned to eliminate duplicates Z: 87 72.206 2.598 0.766 0.578 0.895 0.605 CA 1.757 87 residues pruned to eliminate duplicates Z: 121 107.499 2.679 0.940 0.623 0.942 0.658 CA 1.786 121 residues pruned to eliminate duplicates Z: 54 63.339 2.565 0.678 0.716 0.962 0.792 CA 1.727 54 residues pruned to eliminate duplicates Z: 109 69.297 2.473 0.731 0.559 0.889 0.667 CB 1.656 109 residues pruned to eliminate duplicates Z: 86 70.673 2.599 0.738 0.589 0.906 0.671 CA 1.721 86 residues pruned to eliminate duplicates Z: 63 46.361 2.496 0.426 0.629 0.903 0.694 CA 1.622 63 residues pruned to eliminate duplicates Z: 58 50.924 2.519 0.713 0.540 0.912 0.702 CB 1.647 58 residues pruned to eliminate duplicates Z: 100 61.760 2.467 0.694 0.499 0.919 0.677 CB 1.617 100 residues pruned to eliminate duplicates Z: 60 55.286 2.500 0.663 0.626 0.915 0.678 CA 1.680 60 residues pruned to eliminate duplicates Z: 96 70.824 2.542 0.709 0.539 0.926 0.663 CA 1.737 96 residues pruned to eliminate duplicates Z: 170 108.732 2.616 0.859 0.549 0.917 0.633 CB 1.788 170 residues pruned to eliminate duplicates Z: 153 100.064 2.580 0.824 0.581 0.921 0.651 CA 1.733 175 residues pruned to eliminate duplicates Z: 93 64.270 2.544 0.641 0.532 0.891 0.674 CA 1.746 93 residues pruned to eliminate duplicates Z: 65 51.654 2.478 0.617 0.589 0.891 0.688 CA 1.661 65 residues pruned to eliminate duplicates Z: 85 59.834 2.562 0.623 0.554 0.881 0.619 CA 1.690 85 residues pruned to eliminate duplicates Z: 133 97.125 2.619 0.861 0.619 0.917 0.636 CA 1.691 133 residues pruned to eliminate duplicates Z: 179 103.429 2.563 0.750 0.569 0.910 0.652 CB 1.776 179 residues pruned to eliminate duplicates Z: 197 114.218 2.607 0.761 0.567 0.923 0.633 CA 1.803 197 residues pruned to eliminate duplicates Z: 150 97.484 2.579 0.873 0.585 0.886 0.631 CA 1.720 150 residues pruned to eliminate duplicates Z: 131 99.978 2.641 0.931 0.604 0.892 0.623 CA 1.745 131 residues pruned to eliminate duplicates Z: 87 76.175 2.599 0.827 0.558 0.919 0.605 CA 1.780 87 residues pruned to eliminate duplicates Z: 122 105.172 2.646 0.968 0.625 0.926 0.579 CA 1.764 122 residues pruned to eliminate duplicates Z: 105 70.616 2.524 0.720 0.514 0.933 0.654 CB 1.687 105 residues pruned to eliminate duplicates Z: 208 122.631 2.601 0.861 0.569 0.918 0.686 CA 1.795 198 residues pruned to eliminate duplicates Z: 23 41.315 2.154 0.887 0.894 1.000 0.864 CA 1.555 23 residues pruned to eliminate duplicates Z: 126 71.817 2.470 0.650 0.548 0.904 0.672 CB 1.664 126 residues pruned to eliminate duplicates Z: 58 53.823 2.547 0.687 0.633 0.895 0.684 CA 1.637 58 residues pruned to eliminate duplicates Z: 141 85.596 2.526 0.731 0.528 0.914 0.621 CB 1.760 141 residues pruned to eliminate duplicates Z: 57 59.454 2.543 0.753 0.661 0.911 0.625 CA 1.685 57 residues pruned to eliminate duplicates Z: 148 83.153 2.546 0.632 0.529 0.905 0.673 CA 1.773 148 residues pruned to eliminate duplicates Z: 63 57.917 2.463 0.695 0.601 0.919 0.597 CA 1.741 69 residues pruned to eliminate duplicates Z: 123 74.394 2.499 0.682 0.545 0.893 0.648 CB 1.716 123 residues pruned to eliminate duplicates Z: 172 90.504 2.547 0.697 0.506 0.906 0.626 CA 1.756 172 residues pruned to eliminate duplicates Z: 135 104.764 2.645 0.934 0.607 0.910 0.619 CA 1.756 135 residues pruned to eliminate duplicates Z: 117 103.163 2.678 0.910 0.625 0.948 0.612 CA 1.755 117 residues pruned to eliminate duplicates Z: 85 75.179 2.625 0.796 0.582 0.929 0.667 CA 1.732 85 residues pruned to eliminate duplicates Z: 82 57.779 2.487 0.582 0.542 0.938 0.667 CB 1.670 82 residues pruned to eliminate duplicates Z: 217 122.685 2.590 0.845 0.561 0.931 0.630 CA 1.769 217 residues pruned to eliminate duplicates Z: 172 92.922 2.545 0.727 0.513 0.912 0.637 CA 1.750 172 residues pruned to eliminate duplicates Z: 64 50.139 2.470 0.648 0.502 0.937 0.746 CB 1.653 64 residues pruned to eliminate duplicates Z: 123 72.640 2.461 0.667 0.531 0.910 0.697 CB 1.709 123 residues pruned to eliminate duplicates Z: 123 70.226 2.463 0.636 0.512 0.918 0.590 CB 1.699 77 residues pruned to eliminate duplicates Z: 6 8.117 1.881 0.381 0.435 1.000 0.400 CA 1.494 6 residues pruned to eliminate duplicates Z: 126 71.205 2.463 0.643 0.516 0.920 0.696 CB 1.685 126 residues pruned to eliminate duplicates Z: 64 50.204 2.487 0.648 0.480 0.952 0.635 CB 1.653 64 residues pruned to eliminate duplicates Z: 102 56.795 2.458 0.586 0.441 0.911 0.574 CB 1.691 102 residues pruned to eliminate duplicates Z: 87 59.411 2.537 0.643 0.469 0.907 0.651 CB 1.749 87 residues pruned to eliminate duplicates Z: 65 43.460 2.442 0.542 0.451 0.938 0.656 CB 1.618 65 residues pruned to eliminate duplicates Z: 55 40.570 2.460 0.580 0.436 0.907 0.648 CB 1.673 55 residues pruned to eliminate duplicates Z: 64 47.251 2.469 0.625 0.468 0.937 0.619 CB 1.636 64 residues pruned to eliminate duplicates Z: 26 26.732 2.453 0.788 0.358 0.880 0.640 CB 1.614 26 residues pruned to eliminate duplicates Z: 35 29.458 2.523 0.557 0.346 0.941 0.676 CB 1.616 35 residues pruned to eliminate duplicates Z: 88 59.234 2.510 0.599 0.503 0.943 0.609 CB 1.674 88 residues pruned to eliminate duplicates Z: 87 54.655 2.536 0.554 0.454 0.942 0.651 CB 1.665 87 residues pruned to eliminate duplicates Z: 65 46.697 2.463 0.597 0.476 0.938 0.609 CB 1.623 65 residues pruned to eliminate duplicates Z: 82 46.783 2.424 0.501 0.487 0.914 0.617 CB 1.584 82 residues pruned to eliminate duplicates Z: 66 39.802 2.427 0.524 0.443 0.892 0.569 CB 1.586 66 residues pruned to eliminate duplicates Z: 165 108.261 2.592 0.928 0.536 0.915 0.555 CB 1.786 165 residues pruned to eliminate duplicates Z: 124 70.067 2.485 0.620 0.538 0.902 0.634 CB 1.676 124 residues pruned to eliminate duplicates Z: 124 72.090 2.472 0.645 0.524 0.927 0.642 CB 1.685 124 residues pruned to eliminate duplicates Z: 61 41.091 2.459 0.559 0.464 0.917 0.667 CB 1.566 61 residues pruned to eliminate duplicates Z: 198 111.278 2.583 0.869 0.556 0.898 0.548 CB 1.732 198 residues pruned to eliminate duplicates Z: 38 25.822 2.495 0.569 0.278 0.892 0.486 CB 1.563 38 residues pruned to eliminate duplicates Z: 101 58.880 2.495 0.636 0.454 0.900 0.640 CB 1.680 101 residues pruned to eliminate duplicates Z: 54 52.199 2.564 0.616 0.614 0.887 0.679 CB 1.751 Z: 10 11.167 2.069 0.359 0.859 0.889 0.667 CA 1.096 11 residues pruned to eliminate duplicates Z: 9 15.935 2.320 0.456 0.799 0.875 0.625 CA 1.467 10 residues pruned to eliminate duplicates Z: 11 20.126 2.039 0.664 0.840 1.000 0.700 CA 1.400 10 residues pruned to eliminate duplicates Z: 9 17.324 2.411 0.380 0.738 0.875 0.625 CA 1.699 10 residues pruned to eliminate duplicates Z: 10 15.806 2.361 0.334 0.658 1.000 0.889 CA 1.445 10 residues pruned to eliminate duplicates Z: 75 56.858 2.466 0.651 0.607 0.892 0.676 CB 1.644 52 residues pruned to eliminate duplicates Z: 6 10.538 2.278 0.724 0.375 1.000 0.600 CA 1.372 6 residues pruned to eliminate duplicates Z: 52 59.300 2.601 0.779 0.588 0.941 0.627 CB 1.752 53 residues pruned to eliminate duplicates Z: 6 3.645 1.660 0.299 0.293 1.000 0.600 N 0.954 6 residues pruned to eliminate duplicates Z: 52 54.301 2.609 0.660 0.598 0.902 0.667 CB 1.773 52 residues pruned to eliminate duplicates Z: 6 5.001 1.885 0.689 0.298 0.800 0.600 CA 1.100 6 residues pruned to eliminate duplicates Z: 59 47.931 2.488 0.656 0.529 0.828 0.569 CB 1.793 59 residues pruned to eliminate duplicates Z: 53 52.111 2.581 0.701 0.599 0.885 0.654 CB 1.693 53 residues pruned to eliminate duplicates Z: 131 70.736 2.507 0.692 0.492 0.908 0.638 CB 1.624 175 residues pruned to eliminate duplicates Z: 8 5.665 1.695 0.943 0.390 0.857 0.286 N 0.853 8 residues pruned to eliminate duplicates Z: 51 50.937 2.597 0.595 0.599 0.900 0.640 CB 1.757 51 residues pruned to eliminate duplicates Z: 56 57.620 2.503 0.817 0.593 0.927 0.618 CB 1.686 56 residues pruned to eliminate duplicates Z: 53 46.319 2.506 0.620 0.567 0.923 0.615 CB 1.607 53 residues pruned to eliminate duplicates Z: 41 32.250 2.509 0.325 0.595 0.925 0.700 CB 1.514 41 residues pruned to eliminate duplicates Z: 34 38.285 2.606 0.389 0.695 0.909 0.727 CB 1.696 34 residues pruned to eliminate duplicates Z: 54 51.960 2.570 0.607 0.590 0.906 0.679 CB 1.750 54 residues pruned to eliminate duplicates Z: 35 40.223 2.591 0.545 0.684 0.912 0.676 CB 1.597 35 residues pruned to eliminate duplicates Z: 33 48.474 2.587 0.718 0.747 0.969 0.750 CB 1.595 33 residues pruned to eliminate duplicates Z: 53 46.150 2.541 0.578 0.576 0.865 0.712 CB 1.714 53 residues pruned to eliminate duplicates Z: 53 54.518 2.595 0.710 0.616 0.885 0.712 CB 1.727 53 residues pruned to eliminate duplicates Z: 56 53.066 2.515 0.657 0.574 0.927 0.655 CB 1.725 56 residues pruned to eliminate duplicates Z: 53 59.242 2.592 0.717 0.610 0.942 0.673 CB 1.765 53 residues pruned to eliminate duplicates Z: 35 42.686 2.587 0.633 0.668 0.882 0.706 CB 1.681 35 residues pruned to eliminate duplicates Z: 53 46.962 2.575 0.531 0.608 0.865 0.692 CB 1.723 53 residues pruned to eliminate duplicates Z: 49 32.632 2.405 0.518 0.524 0.854 0.625 CB 1.474 49 residues pruned to eliminate duplicates Z: 35 44.736 2.571 0.643 0.664 0.971 0.618 CB 1.609 35 residues pruned to eliminate duplicates Z: 57 45.446 2.496 0.590 0.559 0.857 0.643 CB 1.685 57 residues pruned to eliminate duplicates Z: 217 96.190 2.518 0.709 0.515 0.884 0.602 CB 1.696 217 residues pruned to eliminate duplicates Z: 68 40.920 2.371 0.523 0.528 0.910 0.642 CB 1.479 75 residues pruned to eliminate duplicates Z: 19 45.652 2.582 0.809 0.873 0.944 0.722 CA 1.776 19 residues pruned to eliminate duplicates Z: 34 47.066 2.600 0.663 0.686 0.939 0.697 CB 1.701 34 residues pruned to eliminate duplicates Z: 59 47.769 2.492 0.642 0.555 0.862 0.621 CB 1.685 59 residues pruned to eliminate duplicates Z: 34 45.396 2.609 0.558 0.700 0.970 0.788 CB 1.671 34 residues pruned to eliminate duplicates Z: 35 44.517 2.582 0.605 0.698 0.941 0.735 CB 1.633 35 residues pruned to eliminate duplicates Z: 57 53.162 2.544 0.673 0.566 0.946 0.679 CB 1.654 57 residues pruned to eliminate duplicates Z: 34 44.108 2.577 0.684 0.699 0.909 0.697 CB 1.623 34 residues pruned to eliminate duplicates Z: 34 45.172 2.597 0.731 0.684 0.909 0.606 CB 1.625 34 residues pruned to eliminate duplicates Z: 38 43.692 2.572 0.740 0.638 0.838 0.649 CB 1.684 38 residues pruned to eliminate duplicates Z: 32 38.339 2.485 0.697 0.651 0.871 0.677 CB 1.629 32 residues pruned to eliminate duplicates Z: 11 14.742 2.579 0.591 0.482 0.900 0.700 CB 1.285 11 residues pruned to eliminate duplicates Z: 52 50.450 2.523 0.770 0.561 0.863 0.647 CB 1.727 52 residues pruned to eliminate duplicates Z: 56 39.314 2.453 0.616 0.535 0.873 0.600 CB 1.482 56 residues pruned to eliminate duplicates Z: 55 46.478 2.445 0.741 0.605 0.926 0.574 CB 1.453 55 residues pruned to eliminate duplicates Z: 40 32.948 2.426 0.616 0.504 0.846 0.538 CB 1.584 40 residues pruned to eliminate duplicates Z: 58 52.479 2.466 0.692 0.646 0.947 0.667 CB 1.534 68 residues pruned to eliminate duplicates Z: 9 6.923 1.442 0.691 0.483 1.000 0.625 CB 1.021 9 residues pruned to eliminate duplicates Z: 56 52.370 2.424 0.813 0.641 0.927 0.673 CB 1.518 56 residues pruned to eliminate duplicates Z: 77 54.181 2.434 0.779 0.556 0.895 0.553 CB 1.519 77 residues pruned to eliminate duplicates Z: 21 15.044 2.166 0.664 0.446 0.800 0.450 CB 1.234 21 residues pruned to eliminate duplicates Z: 71 49.269 2.444 0.538 0.541 0.914 0.614 CB 1.646 71 residues pruned to eliminate duplicates Z: 54 49.962 2.428 0.676 0.646 0.943 0.642 CB 1.559 54 residues pruned to eliminate duplicates Z: 37 32.358 2.368 0.610 0.556 0.944 0.583 CB 1.418 37 residues pruned to eliminate duplicates Z: 19 29.674 2.165 0.767 0.867 0.944 0.611 CB 1.417 19 residues pruned to eliminate duplicates Z: 22 29.858 2.344 0.731 0.704 0.952 0.714 CB 1.400 22 residues pruned to eliminate duplicates Z: 74 66.917 2.459 0.859 0.592 0.959 0.616 CB 1.636 74 residues pruned to eliminate duplicates Z: 19 31.074 2.130 0.746 0.868 1.000 0.667 CB 1.440 19 residues pruned to eliminate duplicates Z: 54 45.087 2.363 0.865 0.629 0.887 0.547 CB 1.403 54 residues pruned to eliminate duplicates Z: 34 34.727 2.373 0.935 0.533 0.970 0.545 CB 1.315 34 residues pruned to eliminate duplicates Z: 33 38.098 2.346 0.970 0.636 0.906 0.562 CB 1.416 33 residues pruned to eliminate duplicates Z: 20 34.935 2.095 1.045 0.874 0.947 0.526 CB 1.437 20 residues pruned to eliminate duplicates Z: 32 30.958 2.426 0.844 0.559 0.871 0.452 CB 1.348 32 residues pruned to eliminate duplicates Z: 33 34.439 2.372 0.864 0.579 1.000 0.594 CB 1.277 33 residues pruned to eliminate duplicates Z: 61 41.989 2.332 0.762 0.491 0.917 0.667 CB 1.452 34 residues pruned to eliminate duplicates Z: 17 21.101 2.143 0.971 0.766 0.750 0.312 CB 1.315 17 residues pruned to eliminate duplicates Z: 158 75.380 2.477 0.621 0.497 0.904 0.611 CB 1.662 116 residues pruned to eliminate duplicates Z: 6 4.891 1.865 0.269 0.406 0.800 0.000 CB 1.274 6 residues pruned to eliminate duplicates Z: 112 71.249 2.576 0.648 0.509 0.901 0.649 CB 1.752 112 residues pruned to eliminate duplicates Z: 124 69.401 2.416 0.738 0.560 0.927 0.642 CB 1.517 124 residues pruned to eliminate duplicates Z: 112 62.968 2.526 0.547 0.492 0.892 0.640 CB 1.729 112 residues pruned to eliminate duplicates Z: 117 67.238 2.548 0.559 0.496 0.905 0.595 CB 1.743 124 residues pruned to eliminate duplicates Z: 130 74.105 2.553 0.593 0.492 0.899 0.628 CB 1.799 120 residues pruned to eliminate duplicates Z: 13 14.412 2.298 0.525 0.326 0.917 0.417 CB 1.569 20 residues pruned to eliminate duplicates Z: 12 15.121 2.352 0.428 0.377 1.000 0.455 CB 1.548 12 residues pruned to eliminate duplicates Z: 124 79.987 2.588 0.618 0.510 0.935 0.626 CB 1.823 131 residues pruned to eliminate duplicates Z: 6 2.760 1.445 0.092 0.465 1.000 0.200 CA 0.810 6 residues pruned to eliminate duplicates Z: 121 76.379 2.601 0.610 0.522 0.917 0.642 CB 1.777 121 residues pruned to eliminate duplicates Z: 72 39.373 2.398 0.472 0.431 0.887 0.577 CB 1.601 72 residues pruned to eliminate duplicates Z: 99 46.447 2.361 0.675 0.452 0.898 0.602 CB 1.388 99 residues pruned to eliminate duplicates Z: 16 8.700 2.195 0.189 0.460 0.733 0.667 CB 1.223 16 residues pruned to eliminate duplicates Z: 26 25.032 2.348 0.601 0.436 0.960 0.600 CB 1.482 26 residues pruned to eliminate duplicates Z: 132 76.991 2.553 0.650 0.505 0.893 0.611 CB 1.779 125 residues pruned to eliminate duplicates Z: 10 16.952 2.033 0.521 0.779 1.000 0.667 CB 1.429 10 residues pruned to eliminate duplicates Z: 118 70.202 2.535 0.618 0.500 0.915 0.624 CB 1.730 118 residues pruned to eliminate duplicates Z: 91 49.647 2.500 0.522 0.449 0.900 0.589 CB 1.610 91 residues pruned to eliminate duplicates Z: 102 61.861 2.562 0.616 0.473 0.931 0.634 CB 1.641 102 residues pruned to eliminate duplicates Z: 71 40.636 2.394 0.555 0.427 0.900 0.571 CB 1.563 71 residues pruned to eliminate duplicates Z: 127 72.061 2.562 0.570 0.502 0.889 0.675 CB 1.792 127 residues pruned to eliminate duplicates Z: 68 54.595 2.611 0.608 0.503 0.910 0.612 CB 1.739 68 residues pruned to eliminate duplicates Z: 121 63.477 2.524 0.570 0.475 0.875 0.617 CB 1.714 121 residues pruned to eliminate duplicates Z: 68 39.542 2.409 0.443 0.447 0.910 0.567 CB 1.612 68 residues pruned to eliminate duplicates Z: 94 87.412 2.678 0.713 0.567 0.935 0.656 CA 1.979 94 residues pruned to eliminate duplicates Z: 69 40.898 2.424 0.516 0.426 0.926 0.603 CB 1.574 69 residues pruned to eliminate duplicates Z: 111 77.543 2.617 0.546 0.533 0.936 0.591 CB 1.890 111 residues pruned to eliminate duplicates Z: 94 75.987 2.689 0.596 0.560 0.903 0.581 CB 1.918 94 residues pruned to eliminate duplicates Z: 74 65.528 2.643 0.698 0.520 0.945 0.589 CB 1.773 74 residues pruned to eliminate duplicates Z: 87 66.248 2.639 0.578 0.561 0.872 0.651 CB 1.855 87 residues pruned to eliminate duplicates Z: 65 53.297 2.605 0.604 0.493 0.922 0.688 CB 1.742 65 residues pruned to eliminate duplicates Z: 85 64.811 2.570 0.641 0.520 0.893 0.607 CB 1.840 85 residues pruned to eliminate duplicates Z: 104 81.802 2.632 0.662 0.534 0.913 0.621 CB 1.953 104 residues pruned to eliminate duplicates Z: 72 40.605 2.396 0.522 0.455 0.915 0.620 CB 1.510 72 residues pruned to eliminate duplicates Z: 98 79.199 2.680 0.547 0.551 0.938 0.680 CB 1.967 98 residues pruned to eliminate duplicates Z: 97 78.667 2.623 0.599 0.570 0.948 0.615 CB 1.887 97 residues pruned to eliminate duplicates Z: 86 79.176 2.695 0.615 0.598 0.918 0.600 CB 1.958 86 residues pruned to eliminate duplicates Z: 66 54.069 2.600 0.604 0.461 0.938 0.554 CB 1.783 66 residues pruned to eliminate duplicates Z: 66 60.926 2.626 0.603 0.560 0.908 0.662 CB 1.866 66 residues pruned to eliminate duplicates Z: 40 37.767 2.462 0.670 0.530 0.897 0.590 CB 1.591 40 residues pruned to eliminate duplicates Z: 62 56.851 2.632 0.578 0.514 0.934 0.607 CB 1.849 62 residues pruned to eliminate duplicates Z: 64 56.020 2.538 0.617 0.518 0.905 0.603 CB 1.867 64 residues pruned to eliminate duplicates Z: 44 35.869 2.427 0.442 0.484 0.953 0.628 CB 1.665 44 residues pruned to eliminate duplicates Z: 75 59.276 2.575 0.603 0.516 0.919 0.581 CB 1.789 75 residues pruned to eliminate duplicates Z: 54 49.937 2.607 0.557 0.558 0.887 0.698 CB 1.801 54 residues pruned to eliminate duplicates Z: 87 76.603 2.656 0.675 0.563 0.884 0.616 CB 1.975 85 residues pruned to eliminate duplicates Z: 13 26.431 2.193 0.591 0.854 1.000 0.667 CB 1.615 13 residues pruned to eliminate duplicates Z: 73 61.802 2.618 0.537 0.572 0.889 0.653 CB 1.898 73 residues pruned to eliminate duplicates Z: 73 61.276 2.626 0.481 0.560 0.917 0.625 CB 1.911 73 residues pruned to eliminate duplicates Z: 62 51.842 2.609 0.579 0.502 0.934 0.672 CB 1.722 62 residues pruned to eliminate duplicates Z: 29 43.530 2.543 0.746 0.643 0.929 0.679 CB 1.746 29 residues pruned to eliminate duplicates Z: 64 43.963 2.562 0.481 0.487 0.889 0.619 CB 1.664 64 residues pruned to eliminate duplicates Z: 63 54.988 2.606 0.508 0.511 0.968 0.613 CB 1.816 63 residues pruned to eliminate duplicates Z: 77 71.093 2.601 0.665 0.600 0.908 0.618 CB 1.885 77 residues pruned to eliminate duplicates Z: 76 56.029 2.576 0.624 0.488 0.893 0.587 CB 1.751 76 residues pruned to eliminate duplicates Z: 39 39.221 2.458 0.628 0.536 0.895 0.579 CB 1.716 39 residues pruned to eliminate duplicates Z: 38 43.156 2.491 0.720 0.563 0.892 0.730 CB 1.746 38 residues pruned to eliminate duplicates Z: 77 76.410 2.696 0.685 0.600 0.895 0.697 CA 1.961 77 residues pruned to eliminate duplicates Z: 80 74.656 2.687 0.625 0.578 0.886 0.658 CB 2.013 80 residues pruned to eliminate duplicates Z: 78 72.767 2.640 0.576 0.579 0.922 0.688 CA 2.003 78 residues pruned to eliminate duplicates Z: 81 62.012 2.614 0.471 0.572 0.913 0.700 CB 1.844 81 residues pruned to eliminate duplicates Z: 69 66.942 2.663 0.640 0.567 0.912 0.632 CA 1.911 69 residues pruned to eliminate duplicates Z: 73 64.674 2.664 0.475 0.561 0.958 0.694 CA 1.908 65 residues pruned to eliminate duplicates Z: 6 16.192 2.179 0.695 0.640 1.000 0.600 CA 1.719 6 residues pruned to eliminate duplicates Z: 49 51.870 2.628 0.632 0.537 0.938 0.667 CB 1.796 49 residues pruned to eliminate duplicates Z: 121 80.768 2.618 0.595 0.506 0.958 0.675 CB 1.832 121 residues pruned to eliminate duplicates Z: 94 66.123 2.646 0.557 0.477 0.903 0.634 CB 1.885 94 residues pruned to eliminate duplicates Z: 80 73.277 2.709 0.652 0.560 0.861 0.671 CA 2.020 80 residues pruned to eliminate duplicates Z: 38 36.148 2.636 0.497 0.427 0.919 0.568 CB 1.768 38 residues pruned to eliminate duplicates Z: 81 77.187 2.670 0.686 0.554 0.938 0.625 CB 1.941 81 residues pruned to eliminate duplicates Z: 81 83.498 2.690 0.741 0.571 0.938 0.688 CB 1.984 93 residues pruned to eliminate duplicates Z: 7 27.663 2.570 0.863 0.827 1.000 0.333 CA 1.777 7 residues pruned to eliminate duplicates Z: 77 78.978 2.721 0.648 0.577 0.934 0.697 CA 2.006 77 residues pruned to eliminate duplicates Z: 86 51.243 2.509 0.559 0.453 0.929 0.576 CB 1.604 86 residues pruned to eliminate duplicates Z: 87 69.271 2.659 0.577 0.540 0.919 0.581 CB 1.865 87 residues pruned to eliminate duplicates Z: 74 60.937 2.640 0.649 0.515 0.918 0.575 CB 1.759 74 residues pruned to eliminate duplicates Z: 75 67.910 2.636 0.610 0.564 0.919 0.662 CA 1.902 75 residues pruned to eliminate duplicates Z: 85 73.246 2.676 0.646 0.536 0.917 0.667 CB 1.911 85 residues pruned to eliminate duplicates Z: 66 49.937 2.591 0.507 0.475 0.938 0.569 CB 1.734 66 residues pruned to eliminate duplicates Z: 78 79.944 2.710 0.696 0.559 0.935 0.597 CA 2.002 78 residues pruned to eliminate duplicates Z: 83 73.637 2.638 0.675 0.516 0.939 0.598 CA 1.929 83 residues pruned to eliminate duplicates Z: 145 81.942 2.557 0.642 0.517 0.924 0.646 CB 1.731 145 residues pruned to eliminate duplicates Z: 93 85.710 2.724 0.667 0.547 0.957 0.630 CB 1.964 93 residues pruned to eliminate duplicates Z: 75 60.570 2.650 0.597 0.497 0.932 0.568 CB 1.789 75 residues pruned to eliminate duplicates Z: 94 85.828 2.717 0.664 0.563 0.946 0.677 CB 1.958 94 residues pruned to eliminate duplicates Z: 80 72.417 2.694 0.615 0.542 0.911 0.633 CA 1.971 80 residues pruned to eliminate duplicates Z: 70 68.887 2.722 0.618 0.555 0.928 0.681 CA 1.924 70 residues pruned to eliminate duplicates Z: 90 74.947 2.671 0.631 0.511 0.921 0.573 CB 1.959 90 residues pruned to eliminate duplicates Z: 72 67.080 2.661 0.641 0.545 0.915 0.634 CA 1.907 72 residues pruned to eliminate duplicates Z: 145 92.653 2.613 0.689 0.559 0.903 0.646 CB 1.830 337 residues pruned to eliminate duplicates Z: 7 8.297 2.190 1.169 0.431 0.500 0.500 CB 1.532 7 residues pruned to eliminate duplicates Z: 78 77.157 2.704 0.696 0.552 0.935 0.675 CA 1.948 78 residues pruned to eliminate duplicates Z: 47 53.814 2.554 0.541 0.574 0.913 0.696 CB 2.057 47 residues pruned to eliminate duplicates Z: 40 54.401 2.647 0.760 0.562 0.923 0.692 CA 1.907 40 residues pruned to eliminate duplicates Z: 75 64.338 2.692 0.541 0.520 0.892 0.608 CA 1.983 75 residues pruned to eliminate duplicates Z: 57 63.238 2.697 0.685 0.545 0.893 0.607 CA 1.992 57 residues pruned to eliminate duplicates Z: 74 67.818 2.693 0.656 0.520 0.918 0.685 CA 1.902 74 residues pruned to eliminate duplicates Z: 87 74.841 2.682 0.651 0.498 0.930 0.698 CB 1.963 87 residues pruned to eliminate duplicates Z: 69 73.750 2.695 0.804 0.530 0.941 0.647 CA 1.898 69 residues pruned to eliminate duplicates Z: 93 79.377 2.719 0.588 0.532 0.957 0.707 CB 1.942 93 residues pruned to eliminate duplicates Z: 90 76.081 2.693 0.608 0.546 0.933 0.607 CB 1.909 90 residues pruned to eliminate duplicates Z: 58 64.125 2.792 0.696 0.537 0.912 0.632 CA 1.895 58 residues pruned to eliminate duplicates Z: 51 55.749 2.737 0.609 0.537 0.920 0.740 CA 1.877 51 residues pruned to eliminate duplicates Z: 65 73.115 2.664 0.754 0.590 0.938 0.609 CA 1.914 65 residues pruned to eliminate duplicates Z: 93 86.809 2.724 0.715 0.525 0.957 0.609 CB 1.976 93 residues pruned to eliminate duplicates Z: 97 80.658 2.633 0.742 0.523 0.948 0.635 CB 1.851 97 residues pruned to eliminate duplicates Z: 95 83.117 2.689 0.731 0.550 0.947 0.649 CB 1.853 95 residues pruned to eliminate duplicates Z: 97 81.492 2.678 0.716 0.521 0.938 0.615 CB 1.891 97 residues pruned to eliminate duplicates Z: 94 77.939 2.668 0.737 0.481 0.925 0.581 CB 1.922 94 residues pruned to eliminate duplicates Z: 87 77.944 2.662 0.712 0.523 0.942 0.721 CB 1.915 87 residues pruned to eliminate duplicates Z: 21 58.186 2.827 0.973 0.734 0.950 0.700 CA 1.990 Z: 21 51.837 2.614 0.800 0.899 0.900 0.650 CA 1.956 21 residues pruned to eliminate duplicates Z: 22 68.183 2.569 1.359 0.842 0.952 0.524 CA 1.921 22 residues pruned to eliminate duplicates Z: 12 18.583 2.192 0.579 0.720 0.909 0.909 CA 1.459 Z: 13 25.207 2.036 1.010 0.669 1.000 0.750 CA 1.521 12 residues pruned to eliminate duplicates Z: 6 10.202 2.068 0.830 0.459 0.800 0.400 CA 1.572 6 residues pruned to eliminate duplicates Z: 6 9.191 2.147 0.863 0.238 0.800 0.400 N 1.740 5 residues pruned to eliminate duplicates Z: 7 6.842 1.456 0.906 0.439 1.000 0.667 N 1.071 6 residues pruned to eliminate duplicates Z: 6 4.392 1.997 0.278 0.420 0.800 0.800 CA 1.045 5 residues pruned to eliminate duplicates Z: 6 5.158 1.839 0.442 0.259 1.000 0.400 N 1.147 Z: 6 8.403 2.100 0.153 0.582 1.000 0.400 N 1.435 4 residues pruned to eliminate duplicates Z: 8 8.077 1.754 0.891 0.710 0.857 0.571 N 0.887 7 residues pruned to eliminate duplicates Z: 155 100.530 2.627 0.818 0.518 0.922 0.558 CB 1.807 25 residues pruned to eliminate duplicates Z: 6 15.786 2.330 0.985 0.551 1.000 0.600 N 1.452 6 residues pruned to eliminate duplicates Z: 252 111.098 2.564 0.708 0.536 0.904 0.562 CB 1.709 164 residues pruned to eliminate duplicates Z: 21 43.290 2.449 0.682 0.827 1.000 0.850 CA 1.771 21 residues pruned to eliminate duplicates Z: 35 44.454 2.541 0.665 0.664 0.912 0.794 CB 1.699 35 residues pruned to eliminate duplicates Z: 142 101.921 2.622 0.845 0.590 0.908 0.582 CB 1.794 142 residues pruned to eliminate duplicates Z: 144 100.591 2.629 0.792 0.601 0.909 0.622 CB 1.783 144 residues pruned to eliminate duplicates Z: 36 42.827 2.513 0.585 0.665 0.914 0.714 CB 1.706 36 residues pruned to eliminate duplicates Z: 34 48.807 2.568 0.757 0.662 0.970 0.727 CB 1.670 34 residues pruned to eliminate duplicates Z: 148 115.414 2.668 0.900 0.602 0.905 0.578 CB 1.883 148 residues pruned to eliminate duplicates Z: 35 40.473 2.519 0.712 0.642 0.912 0.618 CB 1.547 35 residues pruned to eliminate duplicates Z: 182 115.496 2.636 0.817 0.553 0.939 0.619 CB 1.812 182 residues pruned to eliminate duplicates Z: 70 58.086 2.496 0.616 0.602 0.942 0.710 CB 1.670 70 residues pruned to eliminate duplicates Z: 71 57.792 2.496 0.634 0.585 0.929 0.686 CB 1.681 71 residues pruned to eliminate duplicates Z: 30 36.351 2.454 0.583 0.620 0.931 0.655 CB 1.667 30 residues pruned to eliminate duplicates Z: 71 52.263 2.483 0.515 0.591 0.943 0.700 CB 1.614 71 residues pruned to eliminate duplicates Z: 192 105.381 2.581 0.759 0.560 0.911 0.597 CB 1.738 192 residues pruned to eliminate duplicates Z: 62 55.202 2.564 0.667 0.574 0.885 0.656 CA 1.739 62 residues pruned to eliminate duplicates Z: 223 105.980 2.554 0.796 0.524 0.901 0.550 CB 1.681 192 residues pruned to eliminate duplicates Z: 20 33.738 2.428 0.515 0.894 1.000 0.842 CA 1.510 20 residues pruned to eliminate duplicates Z: 73 49.745 2.449 0.512 0.557 0.931 0.625 CB 1.610 73 residues pruned to eliminate duplicates Z: 61 61.777 2.648 0.722 0.564 0.917 0.617 CA 1.793 61 residues pruned to eliminate duplicates Z: 245 119.017 2.578 0.738 0.547 0.930 0.652 CB 1.745 269 residues pruned to eliminate duplicates Z: 9 7.410 1.912 0.714 0.446 0.750 0.125 CA 1.127 9 residues pruned to eliminate duplicates Z: 144 96.594 2.628 0.757 0.576 0.909 0.622 CB 1.788 144 residues pruned to eliminate duplicates Z: 72 40.809 2.384 0.458 0.535 0.887 0.634 CB 1.518 72 residues pruned to eliminate duplicates Z: 71 50.818 2.479 0.475 0.582 0.943 0.671 CB 1.627 70 residues pruned to eliminate duplicates Z: 6 8.048 2.170 0.492 0.404 0.800 0.800 CA 1.538 6 residues pruned to eliminate duplicates Z: 71 52.407 2.477 0.632 0.561 0.914 0.571 CB 1.596 71 residues pruned to eliminate duplicates Z: 63 47.828 2.443 0.528 0.614 0.887 0.645 CB 1.647 63 residues pruned to eliminate duplicates Z: 170 114.822 2.628 0.859 0.586 0.941 0.574 CB 1.770 170 residues pruned to eliminate duplicates Z: 146 95.914 2.632 0.678 0.580 0.910 0.621 CB 1.833 146 residues pruned to eliminate duplicates Z: 89 56.858 2.523 0.481 0.534 0.932 0.693 CB 1.683 89 residues pruned to eliminate duplicates Z: 109 70.260 2.559 0.726 0.530 0.889 0.620 CB 1.672 109 residues pruned to eliminate duplicates Z: 72 53.525 2.463 0.642 0.572 0.915 0.549 CB 1.600 72 residues pruned to eliminate duplicates Z: 69 49.716 2.483 0.457 0.572 0.926 0.691 CB 1.678 69 residues pruned to eliminate duplicates Z: 71 51.804 2.486 0.486 0.573 0.929 0.700 CB 1.682 71 residues pruned to eliminate duplicates Z: 70 51.615 2.479 0.570 0.583 0.928 0.667 CB 1.590 70 residues pruned to eliminate duplicates Z: 76 50.901 2.482 0.499 0.551 0.920 0.653 CB 1.634 76 residues pruned to eliminate duplicates Z: 46 34.490 2.407 0.517 0.471 0.911 0.667 CB 1.591 46 residues pruned to eliminate duplicates Z: 69 48.431 2.458 0.494 0.537 0.926 0.632 CB 1.664 69 residues pruned to eliminate duplicates Z: 169 110.660 2.647 0.754 0.585 0.917 0.619 CB 1.849 169 residues pruned to eliminate duplicates Z: 72 49.839 2.476 0.481 0.563 0.930 0.704 CB 1.632 72 residues pruned to eliminate duplicates Z: 145 102.834 2.650 0.710 0.593 0.931 0.653 CA 1.860 145 residues pruned to eliminate duplicates Z: 145 106.944 2.636 0.865 0.593 0.910 0.653 CB 1.823 145 residues pruned to eliminate duplicates Z: 151 98.025 2.594 0.752 0.559 0.927 0.607 CB 1.794 151 residues pruned to eliminate duplicates Z: 234 114.340 2.581 0.698 0.557 0.931 0.601 CB 1.737 234 residues pruned to eliminate duplicates Z: 63 52.579 2.476 0.622 0.612 0.919 0.629 CB 1.626 63 residues pruned to eliminate duplicates Z: 67 49.284 2.456 0.515 0.592 0.924 0.682 CB 1.615 67 residues pruned to eliminate duplicates Z: 71 50.481 2.484 0.476 0.554 0.957 0.700 CB 1.632 71 residues pruned to eliminate duplicates Z: 72 49.340 2.492 0.468 0.558 0.915 0.690 CB 1.653 72 residues pruned to eliminate duplicates Z: 147 102.065 2.636 0.765 0.574 0.925 0.651 CB 1.828 147 residues pruned to eliminate duplicates Z: 169 66.495 2.463 0.474 0.495 0.893 0.625 CB 1.591 72 residues pruned to eliminate duplicates Z: 21 41.289 2.336 0.841 0.792 1.000 0.700 CA 1.662 21 residues pruned to eliminate duplicates Z: 74 53.603 2.468 0.580 0.557 0.932 0.616 CB 1.634 74 residues pruned to eliminate duplicates Z: 71 57.804 2.488 0.665 0.581 0.929 0.686 CB 1.661 71 residues pruned to eliminate duplicates Z: 107 66.984 2.544 0.599 0.536 0.906 0.632 CB 1.705 107 residues pruned to eliminate duplicates Z: 70 58.615 2.489 0.626 0.579 0.957 0.667 CB 1.690 70 residues pruned to eliminate duplicates Z: 100 70.067 2.525 0.747 0.520 0.909 0.586 CB 1.722 100 residues pruned to eliminate duplicates Z: 70 62.544 2.479 0.730 0.605 0.971 0.696 CB 1.636 70 residues pruned to eliminate duplicates Z: 173 113.032 2.611 0.837 0.586 0.924 0.610 CB 1.790 173 residues pruned to eliminate duplicates Z: 144 105.747 2.638 0.804 0.601 0.923 0.622 CB 1.828 144 residues pruned to eliminate duplicates Z: 72 56.085 2.474 0.692 0.571 0.915 0.634 CB 1.621 72 residues pruned to eliminate duplicates Z: 32 36.459 2.350 0.747 0.487 0.935 0.581 CB 1.728 32 residues pruned to eliminate duplicates Z: 73 52.759 2.470 0.579 0.575 0.917 0.611 CB 1.618 73 residues pruned to eliminate duplicates Z: 71 59.420 2.494 0.747 0.585 0.914 0.671 CB 1.643 71 residues pruned to eliminate duplicates Z: 72 52.573 2.415 0.659 0.568 0.901 0.634 CB 1.618 72 residues pruned to eliminate duplicates Z: 90 65.273 2.513 0.603 0.564 0.944 0.663 CB 1.709 90 residues pruned to eliminate duplicates Z: 252 97.852 2.506 0.588 0.521 0.904 0.625 CB 1.680 203 residues pruned to eliminate duplicates Z: 6 3.208 1.689 0.617 0.100 0.800 0.200 CA 1.094 6 residues pruned to eliminate duplicates Z: 29 25.554 2.379 0.581 0.415 0.893 0.571 CB 1.571 29 residues pruned to eliminate duplicates Z: 93 50.061 2.444 0.533 0.475 0.891 0.620 CB 1.603 93 residues pruned to eliminate duplicates Z: 89 46.083 2.458 0.418 0.468 0.898 0.602 CB 1.622 89 residues pruned to eliminate duplicates Z: 18 15.883 2.411 0.459 0.287 0.882 0.706 CB 1.578 18 residues pruned to eliminate duplicates Z: 68 38.317 2.415 0.358 0.498 0.910 0.687 CB 1.571 68 residues pruned to eliminate duplicates Z: 66 39.109 2.440 0.446 0.497 0.923 0.769 CB 1.493 66 residues pruned to eliminate duplicates Z: 252 105.749 2.540 0.619 0.535 0.916 0.614 CB 1.712 252 residues pruned to eliminate duplicates Z: 69 40.519 2.405 0.475 0.480 0.941 0.632 CB 1.502 69 residues pruned to eliminate duplicates Z: 86 49.006 2.466 0.451 0.466 0.941 0.659 CB 1.634 86 residues pruned to eliminate duplicates Z: 160 89.794 2.573 0.689 0.523 0.918 0.642 CB 1.744 140 residues pruned to eliminate duplicates Z: 8 10.523 1.839 1.077 0.539 1.000 0.714 CB 1.002 8 residues pruned to eliminate duplicates Z: 168 81.019 2.485 0.628 0.499 0.928 0.611 CB 1.671 159 residues pruned to eliminate duplicates Z: 15 22.472 1.970 0.692 0.742 1.000 0.643 CB 1.452 15 residues pruned to eliminate duplicates Z: 29 25.998 2.344 0.598 0.505 0.821 0.571 CB 1.589 29 residues pruned to eliminate duplicates Z: 63 40.432 2.434 0.507 0.482 0.952 0.613 CB 1.497 63 residues pruned to eliminate duplicates Z: 100 51.675 2.482 0.436 0.477 0.909 0.646 CB 1.640 100 residues pruned to eliminate duplicates Z: 46 22.265 2.306 0.373 0.414 0.867 0.444 CB 1.323 46 residues pruned to eliminate duplicates Z: 70 41.552 2.411 0.543 0.470 0.899 0.551 CB 1.543 70 residues pruned to eliminate duplicates Z: 53 31.129 2.285 0.597 0.490 0.885 0.615 CB 1.352 53 residues pruned to eliminate duplicates Z: 92 54.051 2.493 0.483 0.513 0.934 0.670 CB 1.621 92 residues pruned to eliminate duplicates Z: 94 53.249 2.452 0.425 0.501 0.935 0.602 CB 1.687 94 residues pruned to eliminate duplicates Z: 14 21.217 2.241 0.443 0.766 0.923 0.538 CB 1.557 14 residues pruned to eliminate duplicates Z: 64 34.606 2.423 0.431 0.452 0.873 0.603 CB 1.513 64 residues pruned to eliminate duplicates Z: 105 56.706 2.476 0.548 0.478 0.904 0.577 CB 1.641 105 residues pruned to eliminate duplicates Z: 228 109.088 2.544 0.724 0.537 0.916 0.665 CB 1.737 179 residues pruned to eliminate duplicates Z: 7 3.811 1.640 0.566 0.392 0.667 0.167 CA 1.018 Z: 6 5.887 1.588 1.245 0.316 0.800 0.600 CA 1.132 Z: 7 9.222 2.156 0.682 0.448 0.833 0.333 CB 1.315 7 residues pruned to eliminate duplicates Z: 144 65.601 2.371 0.601 0.474 0.909 0.601 CB 1.632 130 residues pruned to eliminate duplicates Z: 7 7.233 1.924 0.449 0.401 1.000 0.833 CA 1.175 7 residues pruned to eliminate duplicates Z: 36 34.285 2.450 0.608 0.515 0.914 0.600 CB 1.585 36 residues pruned to eliminate duplicates Z: 79 38.641 2.413 0.483 0.430 0.846 0.564 CB 1.554 79 residues pruned to eliminate duplicates Z: 63 37.776 2.443 0.507 0.456 0.903 0.597 CB 1.510 63 residues pruned to eliminate duplicates Z: 61 38.344 2.400 0.537 0.433 0.950 0.617 CB 1.513 61 residues pruned to eliminate duplicates Z: 98 52.580 2.469 0.495 0.458 0.907 0.619 CB 1.664 98 residues pruned to eliminate duplicates Z: 72 33.586 2.394 0.390 0.418 0.873 0.606 CB 1.495 72 residues pruned to eliminate duplicates Z: 93 50.659 2.483 0.470 0.457 0.880 0.620 CB 1.717 93 residues pruned to eliminate duplicates Z: 252 107.143 2.524 0.671 0.534 0.916 0.582 CB 1.692 252 residues pruned to eliminate duplicates Z: 64 50.718 2.587 0.484 0.499 0.937 0.651 CB 1.779 64 residues pruned to eliminate duplicates Z: 47 31.489 2.494 0.417 0.370 0.935 0.587 CB 1.616 47 residues pruned to eliminate duplicates Z: 245 109.918 2.559 0.670 0.524 0.922 0.607 CB 1.743 245 residues pruned to eliminate duplicates Z: 79 52.282 2.487 0.522 0.536 0.910 0.590 CB 1.659 86 residues pruned to eliminate duplicates Z: 251 106.542 2.558 0.632 0.525 0.900 0.616 CB 1.751 251 residues pruned to eliminate duplicates Z: 77 43.135 2.459 0.469 0.426 0.921 0.645 CB 1.606 77 residues pruned to eliminate duplicates Z: 76 36.170 2.377 0.479 0.417 0.880 0.533 CB 1.472 76 residues pruned to eliminate duplicates Z: 93 51.648 2.476 0.480 0.497 0.902 0.641 CB 1.633 93 residues pruned to eliminate duplicates Z: 67 38.151 2.395 0.477 0.436 0.924 0.561 CB 1.534 67 residues pruned to eliminate duplicates Z: 79 41.988 2.465 0.488 0.384 0.910 0.577 CB 1.611 79 residues pruned to eliminate duplicates Z: 77 38.966 2.377 0.451 0.442 0.908 0.605 CB 1.515 77 residues pruned to eliminate duplicates Z: 70 36.997 2.407 0.468 0.451 0.899 0.565 CB 1.475 70 residues pruned to eliminate duplicates Z: 95 51.618 2.443 0.567 0.476 0.904 0.585 CB 1.577 95 residues pruned to eliminate duplicates Z: 244 112.173 2.560 0.727 0.538 0.901 0.605 CB 1.740 244 residues pruned to eliminate duplicates Z: 48 25.037 2.373 0.488 0.404 0.851 0.574 CB 1.344 48 residues pruned to eliminate duplicates Z: 45 36.756 2.546 0.470 0.432 0.955 0.591 CB 1.663 45 residues pruned to eliminate duplicates Z: 79 45.745 2.484 0.532 0.439 0.936 0.615 CB 1.549 79 residues pruned to eliminate duplicates Z: 140 78.407 2.567 0.535 0.540 0.906 0.626 CB 1.790 140 residues pruned to eliminate duplicates Z: 77 42.304 2.430 0.586 0.429 0.908 0.592 CB 1.492 77 residues pruned to eliminate duplicates Z: 61 41.535 2.392 0.607 0.495 0.917 0.583 CB 1.529 61 residues pruned to eliminate duplicates Z: 27 29.881 2.521 0.587 0.451 0.885 0.577 CB 1.741 27 residues pruned to eliminate duplicates Z: 15 14.545 2.450 0.432 0.339 0.857 0.357 CB 1.541 15 residues pruned to eliminate duplicates Z: 68 32.673 2.290 0.531 0.382 0.910 0.582 CB 1.418 68 residues pruned to eliminate duplicates Z: 8 18.774 2.340 0.457 0.579 1.000 0.429 CB 1.929 8 residues pruned to eliminate duplicates Z: 29 38.291 2.593 0.511 0.594 0.929 0.500 CB 1.818 29 residues pruned to eliminate duplicates Z: 83 80.918 2.667 0.719 0.619 0.927 0.646 CB 1.880 83 residues pruned to eliminate duplicates Z: 109 49.226 2.428 0.436 0.456 0.889 0.546 CB 1.599 109 residues pruned to eliminate duplicates Z: 141 79.820 2.558 0.624 0.526 0.914 0.650 CB 1.731 141 residues pruned to eliminate duplicates Z: 149 92.598 2.572 0.770 0.535 0.932 0.642 CB 1.732 149 residues pruned to eliminate duplicates Z: 77 49.613 2.466 0.536 0.501 0.921 0.632 CB 1.631 77 residues pruned to eliminate duplicates Z: 67 45.820 2.467 0.503 0.457 0.909 0.621 CB 1.748 67 residues pruned to eliminate duplicates Z: 77 74.009 2.680 0.657 0.611 0.921 0.724 CA 1.867 77 residues pruned to eliminate duplicates Z: 148 109.011 2.661 0.819 0.592 0.918 0.667 CB 1.852 33 residues pruned to eliminate duplicates Z: 18 34.382 2.448 0.548 0.910 1.000 0.765 CA 1.560 18 residues pruned to eliminate duplicates Z: 80 50.329 2.493 0.523 0.478 0.924 0.532 CB 1.650 38 residues pruned to eliminate duplicates Z: 18 54.950 2.545 1.048 0.916 1.000 0.471 CA 1.805 18 residues pruned to eliminate duplicates Z: 43 42.591 2.472 0.712 0.517 0.881 0.333 CB 1.734 43 residues pruned to eliminate duplicates Z: 15 38.313 2.297 1.260 0.779 0.857 0.429 CA 1.799 15 residues pruned to eliminate duplicates Z: 86 48.567 2.469 0.509 0.486 0.906 0.471 CB 1.583 86 residues pruned to eliminate duplicates Z: 26 46.365 2.531 0.911 0.614 0.960 0.520 CA 1.793 26 residues pruned to eliminate duplicates Z: 211 110.359 2.568 0.733 0.547 0.933 0.610 CB 1.751 211 residues pruned to eliminate duplicates Z: 105 104.379 2.715 0.921 0.606 0.923 0.577 CB 1.922 105 residues pruned to eliminate duplicates Z: 161 97.276 2.591 0.845 0.538 0.887 0.556 CB 1.747 161 residues pruned to eliminate duplicates Z: 173 116.046 2.630 0.769 0.604 0.936 0.581 CB 1.841 173 residues pruned to eliminate duplicates Z: 86 89.043 2.711 0.896 0.610 0.894 0.565 CA 1.893 86 residues pruned to eliminate duplicates Z: 79 93.024 2.721 0.922 0.643 0.923 0.603 CA 1.910 79 residues pruned to eliminate duplicates Z: 128 100.675 2.670 0.807 0.620 0.898 0.669 CA 1.842 128 residues pruned to eliminate duplicates Z: 170 114.542 2.622 0.868 0.595 0.911 0.598 CB 1.803 134 residues pruned to eliminate duplicates Z: 7 4.791 2.018 0.550 0.397 0.500 0.333 CB 1.395 Z: 6 7.649 1.784 0.934 0.473 1.000 0.800 CA 1.019 Z: 14 26.746 2.407 0.722 0.682 0.846 0.538 CA 1.789 14 residues pruned to eliminate duplicates Z: 66 97.331 2.770 1.018 0.686 0.923 0.646 CA 1.973 66 residues pruned to eliminate duplicates Z: 69 96.967 2.761 0.945 0.674 0.956 0.662 CA 1.951 69 residues pruned to eliminate duplicates Z: 70 89.814 2.723 0.939 0.678 0.913 0.594 CB 1.903 70 residues pruned to eliminate duplicates Z: 176 111.074 2.618 0.773 0.577 0.926 0.611 CB 1.814 189 residues pruned to eliminate duplicates Z: 14 31.187 2.293 0.787 0.754 0.923 0.692 CA 1.824 14 residues pruned to eliminate duplicates Z: 108 101.407 2.692 0.912 0.636 0.897 0.682 CB 1.868 108 residues pruned to eliminate duplicates Z: 153 110.212 2.634 0.875 0.550 0.941 0.592 CB 1.832 153 residues pruned to eliminate duplicates Z: 50 47.981 2.606 0.667 0.493 0.878 0.551 CB 1.810 50 residues pruned to eliminate duplicates Z: 53 78.418 2.708 0.981 0.657 0.923 0.673 CB 1.899 53 residues pruned to eliminate duplicates Z: 162 107.456 2.628 0.800 0.592 0.907 0.609 CB 1.808 162 residues pruned to eliminate duplicates Z: 144 87.735 2.580 0.722 0.541 0.930 0.622 CB 1.705 144 residues pruned to eliminate duplicates Z: 170 117.801 2.651 0.820 0.610 0.935 0.586 CB 1.810 170 residues pruned to eliminate duplicates Z: 33 73.901 2.827 1.077 0.708 0.938 0.781 CA 1.965 33 residues pruned to eliminate duplicates Z: 155 105.259 2.586 0.870 0.569 0.935 0.649 CB 1.755 155 residues pruned to eliminate duplicates Z: 175 106.638 2.571 0.803 0.576 0.897 0.598 CB 1.808 175 residues pruned to eliminate duplicates Z: 145 100.794 2.630 0.728 0.589 0.944 0.611 CB 1.797 145 residues pruned to eliminate duplicates Z: 134 90.302 2.608 0.768 0.578 0.910 0.564 CB 1.731 134 residues pruned to eliminate duplicates Z: 184 107.079 2.607 0.797 0.553 0.896 0.585 CB 1.791 184 residues pruned to eliminate duplicates Z: 47 77.806 2.811 0.957 0.716 0.891 0.630 CA 1.924 47 residues pruned to eliminate duplicates Z: 49 72.361 2.772 0.910 0.701 0.917 0.583 CA 1.791 49 residues pruned to eliminate duplicates Z: 108 108.590 2.695 1.023 0.642 0.888 0.682 CB 1.899 108 residues pruned to eliminate duplicates Z: 68 87.444 2.727 1.034 0.626 0.896 0.552 CB 1.910 68 residues pruned to eliminate duplicates Z: 213 114.063 2.571 0.851 0.540 0.910 0.514 CB 1.739 213 residues pruned to eliminate duplicates Z: 48 80.406 2.768 0.967 0.700 0.915 0.617 CA 1.961 48 residues pruned to eliminate duplicates Z: 119 89.085 2.627 0.784 0.554 0.941 0.559 CB 1.765 119 residues pruned to eliminate duplicates Z: 81 96.633 2.740 1.115 0.600 0.875 0.625 CA 1.937 81 residues pruned to eliminate duplicates Z: 167 92.715 2.582 0.758 0.560 0.892 0.590 CB 1.678 167 residues pruned to eliminate duplicates Z: 100 106.381 2.690 1.004 0.652 0.899 0.667 CB 1.915 100 residues pruned to eliminate duplicates Z: 247 119.070 2.570 0.770 0.548 0.915 0.614 CB 1.740 247 residues pruned to eliminate duplicates Z: 43 84.029 2.789 1.029 0.716 0.952 0.595 CA 1.979 43 residues pruned to eliminate duplicates Z: 149 102.556 2.615 0.811 0.584 0.919 0.601 CB 1.787 149 residues pruned to eliminate duplicates Z: 184 113.986 2.600 0.885 0.567 0.907 0.612 CB 1.776 183 residues pruned to eliminate duplicates Z: 25 67.337 2.813 1.126 0.938 1.000 0.792 CA 1.598 25 residues pruned to eliminate duplicates Z: 88 87.928 2.627 1.028 0.594 0.897 0.483 CB 1.805 88 residues pruned to eliminate duplicates Z: 123 92.358 2.605 0.832 0.561 0.951 0.598 CB 1.738 123 residues pruned to eliminate duplicates Z: 200 103.287 2.572 0.754 0.535 0.920 0.618 CB 1.706 200 residues pruned to eliminate duplicates Z: 145 103.911 2.614 0.882 0.599 0.889 0.625 CB 1.802 145 residues pruned to eliminate duplicates Z: 88 86.184 2.646 0.973 0.581 0.885 0.517 CB 1.850 88 residues pruned to eliminate duplicates Z: 178 113.415 2.641 0.858 0.558 0.915 0.588 CB 1.794 178 residues pruned to eliminate duplicates Z: 49 81.267 2.783 1.071 0.708 0.917 0.542 CB 1.838 49 residues pruned to eliminate duplicates Z: 122 89.037 2.629 0.822 0.550 0.926 0.545 CB 1.738 122 residues pruned to eliminate duplicates Z: 253 109.412 2.544 0.652 0.530 0.921 0.615 CB 1.730 253 residues pruned to eliminate duplicates Z: 108 91.906 2.617 1.007 0.580 0.860 0.495 CB 1.822 108 residues pruned to eliminate duplicates Z: 69 72.493 2.634 0.911 0.572 0.926 0.574 CB 1.759 69 residues pruned to eliminate duplicates Z: 107 102.360 2.708 0.884 0.629 0.915 0.679 CA 1.886 107 residues pruned to eliminate duplicates Z: 147 109.081 2.662 0.856 0.589 0.911 0.555 CB 1.842 147 residues pruned to eliminate duplicates Z: 176 115.853 2.653 0.858 0.560 0.914 0.571 CB 1.834 176 residues pruned to eliminate duplicates Z: 82 88.202 2.745 0.948 0.589 0.877 0.617 CA 1.919 82 residues pruned to eliminate duplicates Z: 175 114.325 2.621 0.870 0.582 0.914 0.563 CB 1.788 175 residues pruned to eliminate duplicates Z: 172 113.967 2.611 0.817 0.601 0.942 0.579 CB 1.773 172 residues pruned to eliminate duplicates Z: 82 86.438 2.659 0.998 0.576 0.864 0.494 CA 1.944 82 residues pruned to eliminate duplicates Z: 146 104.048 2.618 0.817 0.612 0.903 0.641 CB 1.808 146 residues pruned to eliminate duplicates Z: 194 116.528 2.602 0.854 0.575 0.917 0.617 CB 1.763 194 residues pruned to eliminate duplicates Z: 130 69.774 2.472 0.692 0.494 0.915 0.597 CB 1.615 99 residues pruned to eliminate duplicates Z: 11 38.236 2.421 1.730 0.664 0.900 0.600 CA 1.745 11 residues pruned to eliminate duplicates Z: 140 99.877 2.628 0.805 0.605 0.899 0.640 CB 1.797 140 residues pruned to eliminate duplicates Z: 98 105.587 2.739 0.997 0.604 0.918 0.536 CA 1.936 98 residues pruned to eliminate duplicates Z: 99 72.782 2.555 0.752 0.549 0.898 0.602 CB 1.743 99 residues pruned to eliminate duplicates Z: 24 12.731 2.107 0.387 0.327 0.826 0.435 CB 1.329 Z: 6 3.632 1.725 0.503 0.393 0.600 0.600 CA 1.169 6 residues pruned to eliminate duplicates Z: 19 14.714 2.204 0.375 0.329 0.944 0.500 CB 1.461 21 residues pruned to eliminate duplicates Z: 6 8.273 2.026 0.880 0.457 1.000 0.200 CA 1.016 6 residues pruned to eliminate duplicates Z: 31 12.966 2.038 0.343 0.278 0.800 0.400 CB 1.389 31 residues pruned to eliminate duplicates Z: 23 14.385 2.055 0.362 0.340 0.955 0.500 CB 1.368 19 residues pruned to eliminate duplicates Z: 7 3.131 1.514 0.093 0.516 0.833 0.500 CA 0.912 7 residues pruned to eliminate duplicates Z: 19 17.310 2.185 0.661 0.406 0.889 0.556 CB 1.396 19 residues pruned to eliminate duplicates Z: 8 6.330 2.083 0.334 0.536 0.714 0.571 CB 1.163 8 residues pruned to eliminate duplicates Z: 20 13.141 2.150 0.541 0.321 0.842 0.368 CB 1.317 20 residues pruned to eliminate duplicates Z: 11 6.373 2.070 0.141 0.345 0.900 0.500 CB 1.122 11 residues pruned to eliminate duplicates Z: 28 15.360 2.141 0.467 0.296 0.852 0.259 CB 1.388 54 residues pruned to eliminate duplicates Z: 19 17.823 2.150 0.512 0.435 0.889 0.611 CB 1.555 1377 residues left after pruning, divided into chains as follows: A: 7 B: 6 C: 8 D: 8 E: 6 F: 10 G: 12 H: 7 I: 7 J: 8 K: 6 L: 13 M: 19 N: 19 O: 6 P: 6 Q: 7 R: 16 S: 204 T: 6 U: 51 V: 134 W: 40 X: 184 Y: 284 Z: 18 Z: 16 Z: 251 Z: 18 Residues blocked in groups of 7 to fit allocated memory (-u) CC for partial structure against native data = 27.52 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 1 used as input for final density modification = 0.300, Contrast = 1.081, Connect. = 0.782 for dens.mod. cycle 1 = 0.301, Contrast = 1.170, Connect. = 0.794 for dens.mod. cycle 2 = 0.301, Contrast = 1.409, Connect. = 0.813 for dens.mod. cycle 3 = 0.301, Contrast = 1.401, Connect. = 0.813 for dens.mod. cycle 4 = 0.301, Contrast = 1.400, Connect. = 0.813 for dens.mod. cycle 5 = 0.301, Contrast = 1.379, Connect. = 0.814 for dens.mod. cycle 6 = 0.301, Contrast = 1.365, Connect. = 0.814 for dens.mod. cycle 7 = 0.301, Contrast = 1.349, Connect. = 0.815 for dens.mod. cycle 8 = 0.301, Contrast = 1.336, Connect. = 0.815 for dens.mod. cycle 9 = 0.301, Contrast = 1.324, Connect. = 0.815 for dens.mod. cycle 10 Estimated mean FOM and mapCC as a function of resolution d inf - 4.79 - 3.80 - 3.32 - 3.02 - 2.80 - 2.64 - 2.50 - 2.39 - 2.30 - 2.21 0.694 0.713 0.695 0.653 0.648 0.645 0.630 0.612 0.586 0.576 0.770 0.785 0.773 0.740 0.744 0.746 0.732 0.713 0.686 0.674 N 27355 27412 27319 27032 27735 26460 28989 27877 26077 25787 Estimated mean FOM = 0.646 Pseudo-free CC = 67.08 % Best trace (cycle 1 with CC 31.54%) was saved as ./2aam-2.2-parrot-hancs/2aam-2.2-parrot-hancs.pdb ============================================================================== CPU times required in seconds ----------------------------- 2.6 - Setup, data input and phasing 76.3 - FFTs and peak-searches 142.3 - Sphere of influence 3.0 - Rest of density modification 0.0 - Alpha-helix search 5715.1 - Tripeptide search 48783.9 - Chain tracing 0.0 - NCS analysis 209.2 - B-value refinement for trace 0.9 - Rest of tracing 0.0 - Comparison with known structure ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE finished at 06:57:40 Total time: 54933.78 secs + ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ TimeTaking 925 Used memory is bytes: 24924528