++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 16:34:30 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: ./1vme-1.8-parrot-hancs/1vme-1.8-parrot-hancs.phi -a -n -t20 Cell and symmetry only from ./1vme-1.8-parrot-hancs/1vme-1.8-parrot-hancs.ins Phases from ./1vme-1.8-parrot-hancs/1vme-1.8-parrot-hancs.phi Native data from ./1vme-1.8-parrot-hancs/1vme-1.8-parrot-hancs.hkl Listing output to ./1vme-1.8-parrot-hancs/1vme-1.8-parrot-hancs.lst Phases output to ./1vme-1.8-parrot-hancs/1vme-1.8-parrot-hancs.phs Poly-Ala trace output to ./1vme-1.8-parrot-hancs/1vme-1.8-parrot-hancs.pdb Summary of parameters to be employed: -a 30 global autotracing cycles, stop 3 cycles after CC>30 -b 5.0 extra B for revised heavy atom sites -c 0.400 fraction of pixels in crossover region -d 0.000 high resolution limit to be applied to input data -D unset do not fuse disulfides for NCS -e unset fill in missing data up to maximum resolution + 0.2 Ang. -f unset read intensity not F from native .hkl file -F 0.800 fractional weight for phases from previous global cycle -g 1.100 solvent gamma flipping factor -G 0.700 FOM threshold for initial tripeptides and chain building -i unset no structure inversion -k 4.5 minimum height/sigma for revised heavy atom sites -l 2 space for 2000000 reflections -L 6 minimum number of residues/chain (if more than 3 chains) -m 10 cycles of density modification -p unset no phosphate search -q unset no alpha-helix search -r 3.00 map resolution (multiplies maximum indices) -s 0.450 solvent fraction -S 2.42 radius of sphere of influence -t 10.00 time for initial searches (-t6 or more if difficult) -u 500 MB allocatable memory for fragment optimization -v unset density sharpening factor dependent on resolution -w 0.200 weight for experimental phases after cycle 1 -x unset no phase and trace diagnostics -z unset do not optimize heavy atoms Space group: P 1 21 1 Allowed origin shift code: 2 81222 Reflections read from file ./1vme-1.8-parrot-hancs/1vme-1.8-parrot-hancs.phi 81222 Reflections read from file ./1vme-1.8-parrot-hancs/1vme-1.8-parrot-hancs.hkl 81222 Unique data, highest resolution = 1.802 Angstroms Anisotropic scaling: intensities multiplied by 0.000085h^2 +0.000173k^2 -0.000160l^2 +0.000000kl -0.001672hl +0.000000hk 137 Reflections with d > 2.002 and 0 in range 2.002 > d > 1.802 added Density sharpening factor set to 1.05 Fourier grid = 128 x 256 x 75 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|> = 0.712 = 0.300, Contrast = 0.534, Connect. = 0.781 for dens.mod. cycle 1 = 0.300, Contrast = 0.617, Connect. = 0.792 for dens.mod. cycle 2 = 0.300, Contrast = 0.706, Connect. = 0.805 for dens.mod. cycle 3 = 0.300, Contrast = 0.724, Connect. = 0.810 for dens.mod. cycle 4 = 0.300, Contrast = 0.734, Connect. = 0.813 for dens.mod. cycle 5 = 0.300, Contrast = 0.738, Connect. = 0.815 for dens.mod. cycle 6 = 0.300, Contrast = 0.741, Connect. = 0.816 for dens.mod. cycle 7 = 0.300, Contrast = 0.743, Connect. = 0.817 for dens.mod. cycle 8 = 0.300, Contrast = 0.744, Connect. = 0.818 for dens.mod. cycle 9 = 0.300, Contrast = 0.744, Connect. = 0.819 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 3693 peaks > 0.5 sigma used to seed fragment search Space for about 1045 unique residues taking solvent into account 953 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 16 44.458 2.286 1.435 0.851 0.933 0.800 CB 1.636 B: 15 48.246 2.359 1.201 0.915 1.000 0.857 CA 1.755 C: 14 43.780 2.365 1.217 0.891 1.000 0.846 CA 1.665 15 residues pruned to eliminate duplicates D: 13 37.207 2.341 1.002 0.822 1.000 0.583 CA 1.734 E: 14 45.119 2.405 1.030 0.918 1.000 0.846 CB 1.807 14 residues pruned to eliminate duplicates F: 13 30.135 2.154 0.994 0.813 1.000 0.833 CB 1.543 G: 22 41.937 2.218 0.994 0.912 0.952 0.762 CB 1.538 H: 13 34.695 2.392 0.983 0.820 0.917 0.667 CA 1.745 13 residues pruned to eliminate duplicates I: 10 8.465 2.013 1.020 0.285 0.778 0.222 CA 1.137 J: 37 34.674 2.130 0.891 0.656 0.889 0.722 CB 1.396 K: 15 53.036 2.472 1.302 0.923 1.000 0.857 CB 1.749 15 residues pruned to eliminate duplicates L: 13 21.069 2.321 1.263 0.441 0.750 0.417 CA 1.640 M: 16 28.916 2.069 1.004 0.823 0.867 0.733 CA 1.569 15 residues pruned to eliminate duplicates N: 21 53.982 2.410 1.063 0.872 1.000 0.700 CB 1.770 O: 14 22.946 2.221 0.961 0.383 1.000 0.769 CB 1.654 P: 15 47.315 2.374 1.174 0.922 1.000 0.714 CB 1.723 15 residues pruned to eliminate duplicates Q: 13 32.273 2.383 0.930 0.867 0.917 0.667 CA 1.616 13 residues pruned to eliminate duplicates R: 12 32.667 2.459 0.737 0.821 1.000 0.636 CA 1.746 12 residues pruned to eliminate duplicates S: 18 21.037 2.142 0.575 0.755 0.882 0.765 CB 1.365 T: 20 50.272 2.400 1.012 0.908 0.947 0.789 CA 1.791 20 residues pruned to eliminate duplicates U: 22 44.036 2.388 0.934 0.870 0.905 0.762 CB 1.679 22 residues pruned to eliminate duplicates V: 13 25.004 2.239 0.988 0.727 0.917 0.583 CB 1.442 W: 13 26.142 2.177 1.230 0.753 0.833 0.500 CB 1.489 13 residues pruned to eliminate duplicates X: 15 55.932 2.471 1.350 0.923 1.000 1.000 CB 1.809 15 residues pruned to eliminate duplicates Y: 16 21.919 2.133 0.822 0.748 0.800 0.667 CB 1.459 16 residues pruned to eliminate duplicates Z: 25 36.942 2.388 1.095 0.463 0.917 0.417 CB 1.707 8 residues pruned to eliminate duplicates Z: 15 46.413 2.384 1.289 0.933 0.929 0.857 CA 1.709 15 residues pruned to eliminate duplicates Z: 22 44.119 2.191 1.092 0.890 0.952 0.714 CB 1.586 22 residues pruned to eliminate duplicates Z: 14 37.133 2.284 1.136 0.931 1.000 0.846 CB 1.474 14 residues pruned to eliminate duplicates Z: 38 54.267 2.298 0.781 0.875 1.000 0.730 CB 1.585 21 residues pruned to eliminate duplicates Z: 13 18.707 2.173 1.171 0.511 0.750 0.500 CB 1.509 12 residues pruned to eliminate duplicates Z: 17 21.512 2.187 1.079 0.496 0.875 0.500 CB 1.357 Z: 29 35.386 2.310 0.950 0.526 0.857 0.643 CB 1.689 13 residues pruned to eliminate duplicates Z: 15 50.456 2.376 1.390 0.914 1.000 0.929 CA 1.679 14 residues pruned to eliminate duplicates Z: 12 30.980 2.365 0.969 0.864 0.818 0.545 CB 1.797 12 residues pruned to eliminate duplicates Z: 14 32.525 2.381 0.588 0.922 1.000 0.923 CB 1.677 17 residues pruned to eliminate duplicates Z: 10 32.971 2.351 0.908 0.861 1.000 0.889 CA 1.800 12 residues pruned to eliminate duplicates Z: 35 40.083 2.299 1.044 0.504 0.912 0.618 CB 1.598 29 residues pruned to eliminate duplicates Z: 15 51.555 2.319 1.484 0.905 1.000 0.857 CA 1.702 15 residues pruned to eliminate duplicates Z: 15 53.024 2.369 1.370 0.922 1.000 0.857 CA 1.776 15 residues pruned to eliminate duplicates Z: 95 50.386 2.226 0.932 0.488 0.830 0.489 CB 1.474 12 residues pruned to eliminate duplicates Z: 33 37.054 2.291 1.006 0.508 0.938 0.594 CB 1.508 14 residues pruned to eliminate duplicates Z: 23 28.258 2.231 1.128 0.456 0.818 0.364 CB 1.623 13 residues pruned to eliminate duplicates Z: 35 35.858 2.061 0.846 0.665 0.941 0.647 CB 1.475 Z: 16 33.370 2.274 0.888 0.836 0.933 0.800 CB 1.610 14 residues pruned to eliminate duplicates Z: 16 36.147 2.219 1.073 0.821 1.000 0.600 CA 1.536 10 residues pruned to eliminate duplicates Z: 20 44.969 2.403 0.837 0.918 0.947 0.842 CB 1.740 20 residues pruned to eliminate duplicates Z: 14 21.669 2.226 0.749 0.516 0.923 0.538 CB 1.647 14 residues pruned to eliminate duplicates Z: 16 43.057 2.282 1.267 0.889 0.933 0.800 CA 1.659 16 residues pruned to eliminate duplicates Z: 14 46.572 2.364 1.264 0.897 1.000 0.846 CA 1.727 14 residues pruned to eliminate duplicates Z: 45 43.038 2.326 1.000 0.468 0.932 0.545 CB 1.547 28 residues pruned to eliminate duplicates Z: 18 16.481 2.146 0.818 0.447 0.824 0.529 CB 1.313 18 residues pruned to eliminate duplicates Z: 16 40.157 2.278 1.036 0.856 1.000 0.933 CA 1.649 16 residues pruned to eliminate duplicates Z: 29 46.788 2.421 1.189 0.540 0.964 0.750 CB 1.664 31 residues pruned to eliminate duplicates Z: 15 37.187 2.189 1.194 0.923 1.000 0.857 CB 1.454 17 residues pruned to eliminate duplicates Z: 31 36.604 2.391 0.944 0.438 0.900 0.533 CB 1.703 31 residues pruned to eliminate duplicates Z: 16 27.540 2.020 0.687 0.929 1.000 0.733 CB 1.461 Z: 16 30.597 2.214 0.956 0.869 0.933 0.867 CB 1.428 16 residues pruned to eliminate duplicates Z: 65 41.591 2.069 0.852 0.595 0.906 0.625 CB 1.368 39 residues pruned to eliminate duplicates Z: 10 28.946 2.424 0.838 0.885 0.889 0.556 CB 1.759 10 residues pruned to eliminate duplicates Z: 11 29.788 2.273 1.051 0.869 1.000 0.900 CB 1.476 11 residues pruned to eliminate duplicates Z: 53 53.121 2.181 1.114 0.621 0.962 0.654 CB 1.482 49 residues pruned to eliminate duplicates Z: 14 25.876 2.310 0.769 0.807 0.846 0.769 CB 1.589 Z: 15 31.174 2.262 0.728 0.939 1.000 0.929 CB 1.482 15 residues pruned to eliminate duplicates Z: 16 39.292 2.320 1.088 0.912 0.933 0.867 CB 1.589 16 residues pruned to eliminate duplicates Z: 11 27.616 2.211 1.087 0.864 0.900 0.800 CA 1.541 11 residues pruned to eliminate duplicates Z: 19 31.675 2.205 0.563 0.878 1.000 0.889 CA 1.572 19 residues pruned to eliminate duplicates Z: 26 32.318 2.300 1.123 0.483 0.920 0.600 CB 1.464 26 residues pruned to eliminate duplicates Z: 8 9.055 2.135 0.879 0.495 0.571 0.571 CB 1.500 4 residues pruned to eliminate duplicates Z: 26 38.427 2.341 1.021 0.576 0.920 0.640 CB 1.641 26 residues pruned to eliminate duplicates Z: 16 31.076 2.160 1.071 0.835 0.933 0.667 CB 1.440 14 residues pruned to eliminate duplicates Z: 20 18.565 1.982 0.405 0.843 0.895 0.684 CB 1.272 19 residues pruned to eliminate duplicates Z: 19 26.455 2.086 0.636 0.758 0.944 0.667 CB 1.537 19 residues pruned to eliminate duplicates Z: 22 41.275 2.149 0.941 0.917 1.000 0.857 CB 1.523 22 residues pruned to eliminate duplicates Z: 59 42.731 2.168 0.869 0.600 0.897 0.672 CB 1.404 55 residues pruned to eliminate duplicates Z: 10 28.693 2.239 0.899 0.903 1.000 0.889 CA 1.603 10 residues pruned to eliminate duplicates Z: 61 48.729 2.149 1.000 0.604 0.900 0.617 CB 1.473 60 residues pruned to eliminate duplicates Z: 38 47.387 2.216 0.674 0.860 1.000 0.730 CB 1.544 38 residues pruned to eliminate duplicates Z: 16 24.995 1.938 0.653 0.921 0.933 0.733 CB 1.519 16 residues pruned to eliminate duplicates Z: 17 26.713 1.955 0.691 0.924 1.000 0.812 CB 1.419 17 residues pruned to eliminate duplicates Z: 16 36.435 2.226 1.131 0.805 0.933 0.600 CB 1.629 16 residues pruned to eliminate duplicates Z: 56 36.642 2.111 1.047 0.420 0.909 0.473 CB 1.367 56 residues pruned to eliminate duplicates Z: 13 22.145 1.986 0.763 0.816 1.000 0.750 CA 1.388 15 residues pruned to eliminate duplicates Z: 15 51.410 2.439 1.443 0.931 0.929 0.786 CB 1.736 16 residues pruned to eliminate duplicates Z: 43 39.941 2.263 1.003 0.468 0.857 0.524 CB 1.638 43 residues pruned to eliminate duplicates Z: 13 30.942 2.369 0.846 0.850 1.000 1.000 CA 1.513 13 residues pruned to eliminate duplicates Z: 66 51.745 2.200 1.056 0.572 0.908 0.615 CB 1.458 66 residues pruned to eliminate duplicates Z: 36 37.109 2.191 0.919 0.522 0.943 0.600 CB 1.548 36 residues pruned to eliminate duplicates Z: 99 55.095 2.159 0.942 0.562 0.888 0.571 CB 1.408 72 residues pruned to eliminate duplicates Z: 14 20.842 2.166 0.822 0.405 1.000 0.538 CB 1.619 14 residues pruned to eliminate duplicates Z: 10 17.860 2.119 0.372 0.876 1.000 0.778 CB 1.489 10 residues pruned to eliminate duplicates Z: 17 31.732 2.144 1.194 0.819 0.875 0.500 CA 1.461 17 residues pruned to eliminate duplicates Z: 12 25.737 2.369 0.794 0.864 0.909 0.636 CA 1.472 12 residues pruned to eliminate duplicates Z: 16 29.797 2.211 0.793 0.853 1.000 0.733 CB 1.434 15 residues pruned to eliminate duplicates Z: 20 25.612 2.197 0.848 0.543 0.947 0.632 CB 1.466 20 residues pruned to eliminate duplicates Z: 22 50.458 2.264 1.067 0.883 1.000 0.714 CB 1.700 22 residues pruned to eliminate duplicates Z: 20 45.899 2.256 1.049 0.911 1.000 0.842 CB 1.614 21 residues pruned to eliminate duplicates Z: 18 26.813 2.148 0.586 0.780 1.000 0.824 CB 1.491 18 residues pruned to eliminate duplicates Z: 23 23.809 2.181 0.991 0.369 0.864 0.500 CB 1.557 23 residues pruned to eliminate duplicates Z: 14 30.428 2.013 0.890 0.861 1.000 0.538 CA 1.630 14 residues pruned to eliminate duplicates Z: 20 31.193 2.396 0.779 0.576 0.895 0.579 CB 1.744 20 residues pruned to eliminate duplicates Z: 22 46.347 2.184 1.226 0.889 0.952 0.762 CA 1.572 22 residues pruned to eliminate duplicates Z: 22 21.917 2.279 0.954 0.445 0.810 0.524 CB 1.404 22 residues pruned to eliminate duplicates Z: 38 32.463 2.285 0.776 0.393 0.865 0.432 CB 1.702 38 residues pruned to eliminate duplicates Z: 12 24.225 2.155 0.870 0.821 1.000 0.727 CB 1.372 12 residues pruned to eliminate duplicates Z: 17 28.441 1.970 0.773 0.930 1.000 0.750 CB 1.424 16 residues pruned to eliminate duplicates Z: 50 32.643 2.093 0.835 0.519 0.898 0.694 CB 1.328 50 residues pruned to eliminate duplicates Z: 15 29.907 2.291 0.873 0.845 1.000 0.714 CB 1.385 16 residues pruned to eliminate duplicates Z: 14 13.367 2.050 0.718 0.424 0.769 0.462 CB 1.480 14 residues pruned to eliminate duplicates Z: 7 7.888 1.744 0.571 0.766 0.833 0.333 CB 1.114 7 residues pruned to eliminate duplicates Z: 7 33.878 2.588 1.046 0.909 1.000 1.000 CB 1.854 7 residues pruned to eliminate duplicates Z: 29 40.267 2.267 0.923 0.591 1.000 0.679 CB 1.601 17 residues pruned to eliminate duplicates Z: 12 18.232 2.132 0.670 0.887 0.818 0.727 CB 1.361 12 residues pruned to eliminate duplicates Z: 17 27.604 2.130 1.076 0.785 0.875 0.625 CB 1.388 17 residues pruned to eliminate duplicates Z: 16 24.203 2.150 0.596 0.821 0.867 0.667 CA 1.591 16 residues pruned to eliminate duplicates Z: 20 31.894 2.160 0.560 0.914 1.000 0.842 CB 1.535 20 residues pruned to eliminate duplicates Z: 16 38.536 2.204 1.082 0.824 1.000 0.733 CB 1.637 16 residues pruned to eliminate duplicates Z: 18 31.372 2.174 1.018 0.505 1.000 0.588 CB 1.725 18 residues pruned to eliminate duplicates Z: 25 33.567 2.399 1.077 0.427 0.875 0.500 CB 1.696 25 residues pruned to eliminate duplicates Z: 21 34.154 2.206 0.799 0.882 0.950 0.850 CB 1.466 21 residues pruned to eliminate duplicates Z: 46 43.962 2.276 0.853 0.552 0.911 0.622 CB 1.622 29 residues pruned to eliminate duplicates Z: 15 14.126 1.968 0.560 0.403 1.000 0.571 CB 1.363 Z: 14 29.276 2.266 0.875 0.657 1.000 0.615 CB 1.651 14 residues pruned to eliminate duplicates Z: 10 32.092 2.236 1.088 0.909 1.000 0.889 CB 1.626 10 residues pruned to eliminate duplicates Z: 36 31.675 2.222 0.807 0.483 0.857 0.600 CB 1.583 36 residues pruned to eliminate duplicates Z: 13 48.826 2.471 1.126 0.926 1.000 0.917 CB 1.882 13 residues pruned to eliminate duplicates Z: 22 47.045 2.411 0.980 0.868 0.905 0.667 CB 1.737 22 residues pruned to eliminate duplicates Z: 10 40.670 2.247 1.511 0.873 1.000 0.778 CA 1.750 10 residues pruned to eliminate duplicates Z: 55 31.735 2.116 0.780 0.467 0.852 0.648 CB 1.392 22 residues pruned to eliminate duplicates Z: 20 47.697 2.361 0.984 0.904 0.947 0.737 CB 1.756 20 residues pruned to eliminate duplicates Z: 14 26.857 2.146 0.931 0.803 0.846 0.615 CA 1.631 14 residues pruned to eliminate duplicates Z: 13 34.019 2.158 1.391 0.847 1.000 0.917 CB 1.413 13 residues pruned to eliminate duplicates Z: 20 25.464 2.049 0.805 0.548 1.000 0.842 CB 1.507 Z: 16 25.332 1.963 0.607 0.946 0.933 0.800 CB 1.536 16 residues pruned to eliminate duplicates Z: 16 33.910 2.015 1.084 0.954 1.000 0.800 CB 1.434 17 residues pruned to eliminate duplicates Z: 17 24.330 2.112 0.535 0.814 1.000 0.875 CB 1.428 17 residues pruned to eliminate duplicates Z: 14 32.386 2.256 0.902 0.839 0.923 0.615 CB 1.693 14 residues pruned to eliminate duplicates Z: 99 54.938 2.165 0.979 0.555 0.898 0.510 CB 1.368 99 residues pruned to eliminate duplicates Z: 16 26.432 2.116 0.650 0.812 0.933 0.667 CB 1.596 16 residues pruned to eliminate duplicates Z: 15 22.915 2.063 0.734 0.928 1.000 0.929 CB 1.199 15 residues pruned to eliminate duplicates Z: 23 23.283 2.118 1.165 0.516 0.955 0.591 CB 1.117 23 residues pruned to eliminate duplicates Z: 17 18.193 2.166 0.828 0.389 0.812 0.438 CB 1.591 17 residues pruned to eliminate duplicates Z: 20 31.427 2.155 0.630 0.871 1.000 0.579 CB 1.497 20 residues pruned to eliminate duplicates Z: 20 14.829 1.919 0.744 0.387 0.789 0.526 CB 1.451 18 residues pruned to eliminate duplicates Z: 14 42.306 2.403 1.040 0.944 1.000 0.923 CB 1.658 14 residues pruned to eliminate duplicates Z: 94 59.381 2.189 1.043 0.577 0.914 0.591 CB 1.399 94 residues pruned to eliminate duplicates Z: 28 21.364 2.235 1.019 0.384 0.778 0.481 CB 1.325 28 residues pruned to eliminate duplicates Z: 30 24.989 2.075 0.893 0.494 0.897 0.621 CB 1.326 30 residues pruned to eliminate duplicates Z: 21 16.123 2.030 0.964 0.399 0.900 0.500 CB 1.117 19 residues pruned to eliminate duplicates Z: 13 22.932 2.086 0.800 0.813 0.917 0.833 CA 1.465 13 residues pruned to eliminate duplicates Z: 16 31.387 2.193 0.722 0.826 1.000 0.800 CB 1.618 16 residues pruned to eliminate duplicates Z: 21 18.540 2.211 0.856 0.491 0.850 0.500 CB 1.199 21 residues pruned to eliminate duplicates Z: 31 26.354 2.054 1.026 0.471 0.900 0.600 CB 1.323 30 residues pruned to eliminate duplicates Z: 20 13.941 1.887 0.632 0.396 0.947 0.526 CB 1.223 20 residues pruned to eliminate duplicates Z: 23 38.082 2.355 0.826 0.880 0.864 0.682 CB 1.584 23 residues pruned to eliminate duplicates Z: 32 33.478 2.285 0.924 0.416 0.903 0.613 CB 1.653 32 residues pruned to eliminate duplicates Z: 26 39.846 2.235 0.982 0.594 1.000 0.720 CB 1.644 26 residues pruned to eliminate duplicates Z: 14 24.389 2.193 0.538 0.938 1.000 0.923 CB 1.394 14 residues pruned to eliminate duplicates Z: 13 17.482 2.116 0.370 0.888 0.917 0.833 CB 1.368 13 residues pruned to eliminate duplicates Z: 35 31.296 2.004 0.989 0.866 0.912 0.559 CB 1.081 20 residues pruned to eliminate duplicates Z: 31 42.697 2.386 1.123 0.526 0.933 0.700 CB 1.608 31 residues pruned to eliminate duplicates Z: 17 38.294 2.136 1.148 0.835 1.000 0.562 CA 1.564 17 residues pruned to eliminate duplicates Z: 16 26.344 2.008 0.602 0.940 1.000 0.933 CB 1.468 16 residues pruned to eliminate duplicates Z: 16 35.142 2.155 0.996 0.823 1.000 0.533 CB 1.594 16 residues pruned to eliminate duplicates Z: 23 25.485 2.227 0.951 0.469 0.864 0.545 CB 1.495 23 residues pruned to eliminate duplicates Z: 21 49.370 2.372 1.129 0.913 0.900 0.800 CB 1.719 21 residues pruned to eliminate duplicates Z: 13 28.325 2.034 1.326 0.824 0.917 0.667 CB 1.424 13 residues pruned to eliminate duplicates Z: 31 18.219 1.971 0.651 0.430 0.833 0.533 CB 1.320 31 residues pruned to eliminate duplicates Z: 68 50.997 2.130 0.994 0.591 0.910 0.567 CB 1.477 64 residues pruned to eliminate duplicates Z: 40 35.366 2.236 0.951 0.507 0.872 0.615 CB 1.479 40 residues pruned to eliminate duplicates Z: 33 32.853 2.139 0.945 0.460 0.938 0.562 CB 1.551 33 residues pruned to eliminate duplicates Z: 13 30.856 2.385 0.811 0.899 1.000 0.833 CA 1.474 13 residues pruned to eliminate duplicates Z: 14 28.148 2.218 0.806 0.927 1.000 1.000 CB 1.365 14 residues pruned to eliminate duplicates Z: 36 39.808 2.195 0.880 0.616 0.914 0.657 CB 1.598 36 residues pruned to eliminate duplicates Z: 23 52.632 2.394 1.025 0.902 0.955 0.727 CB 1.730 23 residues pruned to eliminate duplicates Z: 109 71.685 2.226 0.876 0.639 0.954 0.704 CB 1.521 103 residues pruned to eliminate duplicates Z: 7 15.984 2.253 0.847 0.645 1.000 0.833 CB 1.370 7 residues pruned to eliminate duplicates Z: 16 41.941 2.325 1.014 0.896 0.933 0.867 CA 1.776 16 residues pruned to eliminate duplicates Z: 8 15.077 1.928 1.141 0.736 0.857 0.857 CA 1.303 8 residues pruned to eliminate duplicates Z: 16 25.744 1.926 0.830 0.910 1.000 0.467 CB 1.338 16 residues pruned to eliminate duplicates Z: 39 33.147 2.221 0.939 0.438 0.868 0.447 CB 1.533 39 residues pruned to eliminate duplicates Z: 7 2.313 1.658 -0.316 0.699 0.833 0.833 CB 0.833 Z: 38 32.410 2.118 0.897 0.609 0.865 0.595 CB 1.382 38 residues pruned to eliminate duplicates Z: 29 15.808 1.846 0.587 0.466 0.857 0.607 CB 1.231 Z: 8 25.158 2.156 0.942 0.912 1.000 0.857 CB 1.608 8 residues pruned to eliminate duplicates Z: 16 21.092 2.256 1.141 0.347 0.867 0.400 CB 1.536 16 residues pruned to eliminate duplicates Z: 10 14.948 1.925 0.799 0.527 1.000 0.556 CB 1.401 10 residues pruned to eliminate duplicates Z: 13 29.078 1.944 0.972 0.803 1.000 0.667 CB 1.681 13 residues pruned to eliminate duplicates Z: 21 37.226 2.240 0.839 0.909 0.950 0.800 CB 1.509 21 residues pruned to eliminate duplicates Z: 32 22.094 1.974 0.904 0.446 0.871 0.581 CB 1.282 32 residues pruned to eliminate duplicates Z: 68 46.865 2.220 0.854 0.558 0.896 0.627 CB 1.469 68 residues pruned to eliminate duplicates Z: 61 52.500 2.277 0.826 0.567 0.950 0.650 CB 1.608 61 residues pruned to eliminate duplicates Z: 31 46.473 2.245 1.149 0.627 1.000 0.733 CB 1.561 30 residues pruned to eliminate duplicates Z: 23 50.064 2.403 1.060 0.874 0.909 0.727 CB 1.727 23 residues pruned to eliminate duplicates Z: 15 18.325 1.798 0.368 0.909 1.000 0.786 CB 1.413 15 residues pruned to eliminate duplicates Z: 55 36.389 2.107 0.991 0.480 0.870 0.630 CB 1.384 44 residues pruned to eliminate duplicates Z: 13 19.357 2.100 0.551 0.841 0.917 0.667 CB 1.396 13 residues pruned to eliminate duplicates Z: 90 57.347 2.231 0.931 0.545 0.933 0.539 CB 1.448 90 residues pruned to eliminate duplicates Z: 20 24.960 2.176 0.983 0.507 0.895 0.421 CB 1.473 20 residues pruned to eliminate duplicates Z: 8 7.650 1.721 0.787 0.485 0.857 0.571 CB 1.113 Z: 16 20.450 1.876 1.047 0.523 1.000 0.800 CB 1.344 Z: 24 25.398 2.047 1.011 0.581 0.826 0.522 CB 1.441 24 residues pruned to eliminate duplicates Z: 78 52.141 2.157 0.908 0.577 0.935 0.597 CB 1.434 78 residues pruned to eliminate duplicates Z: 36 34.704 2.082 0.744 0.849 0.886 0.657 CB 1.352 35 residues pruned to eliminate duplicates Z: 15 28.290 2.111 0.757 0.935 1.000 0.786 CB 1.420 15 residues pruned to eliminate duplicates Z: 18 33.407 2.006 1.125 0.929 1.000 0.706 CB 1.329 22 residues pruned to eliminate duplicates Z: 15 52.016 2.327 1.695 0.934 0.929 0.786 CB 1.665 15 residues pruned to eliminate duplicates Z: 99 58.351 2.181 1.058 0.544 0.888 0.602 CB 1.417 99 residues pruned to eliminate duplicates Z: 11 10.042 2.017 0.624 0.322 0.900 0.500 CB 1.311 11 residues pruned to eliminate duplicates Z: 16 25.106 1.976 0.588 0.936 1.000 1.000 CB 1.439 16 residues pruned to eliminate duplicates Z: 22 25.655 1.924 1.058 0.714 0.905 0.524 CB 1.287 22 residues pruned to eliminate duplicates Z: 40 32.943 2.039 0.922 0.640 0.872 0.744 CB 1.355 40 residues pruned to eliminate duplicates Z: 14 27.438 2.028 1.208 0.811 0.923 0.692 CB 1.405 14 residues pruned to eliminate duplicates Z: 6 9.691 1.800 0.399 0.782 1.000 1.000 N 1.343 6 residues pruned to eliminate duplicates Z: 14 28.904 2.214 0.813 0.925 1.000 0.923 CB 1.402 14 residues pruned to eliminate duplicates Z: 19 26.510 1.914 0.682 0.861 1.000 0.833 CB 1.427 19 residues pruned to eliminate duplicates Z: 16 22.128 1.958 0.654 0.925 1.000 0.933 CB 1.238 16 residues pruned to eliminate duplicates Z: 13 20.989 2.081 0.856 0.842 1.000 0.833 CB 1.169 13 residues pruned to eliminate duplicates Z: 10 20.855 2.288 0.681 0.621 1.000 0.667 CA 1.613 10 residues pruned to eliminate duplicates Z: 18 25.801 2.166 0.515 0.808 1.000 0.765 CB 1.458 18 residues pruned to eliminate duplicates Z: 14 28.935 2.133 1.028 0.854 0.923 0.846 CB 1.484 14 residues pruned to eliminate duplicates Z: 13 17.942 2.238 0.928 0.373 0.917 0.417 CB 1.500 13 residues pruned to eliminate duplicates Z: 75 57.583 2.187 1.035 0.596 0.946 0.608 CB 1.451 75 residues pruned to eliminate duplicates Z: 16 27.832 2.012 0.755 0.941 1.000 0.733 CB 1.412 16 residues pruned to eliminate duplicates Z: 16 24.917 2.037 0.422 0.940 1.000 1.000 CB 1.541 16 residues pruned to eliminate duplicates Z: 14 30.301 2.235 0.785 0.938 1.000 0.923 CB 1.465 14 residues pruned to eliminate duplicates Z: 19 42.849 2.193 1.197 0.923 0.944 0.833 CB 1.560 19 residues pruned to eliminate duplicates Z: 10 28.742 2.155 0.964 0.884 1.000 0.889 CB 1.636 10 residues pruned to eliminate duplicates Z: 14 9.682 1.863 0.246 0.385 0.923 0.692 CB 1.416 14 residues pruned to eliminate duplicates Z: 17 38.418 2.075 1.215 0.939 1.000 0.750 CB 1.452 17 residues pruned to eliminate duplicates Z: 30 42.775 2.278 1.017 0.595 0.966 0.724 CB 1.635 31 residues pruned to eliminate duplicates Z: 29 17.650 1.859 0.749 0.500 0.857 0.607 CB 1.197 32 residues pruned to eliminate duplicates Z: 40 41.946 2.223 0.651 0.812 0.923 0.718 CB 1.512 40 residues pruned to eliminate duplicates Z: 16 11.536 2.110 0.606 0.320 0.867 0.400 CB 1.237 16 residues pruned to eliminate duplicates Z: 15 41.513 2.306 1.219 0.909 0.929 0.929 CB 1.657 15 residues pruned to eliminate duplicates Z: 17 24.163 1.912 0.633 0.952 1.000 0.875 CB 1.333 17 residues pruned to eliminate duplicates Z: 20 40.658 2.229 0.874 0.898 1.000 0.842 CB 1.597 20 residues pruned to eliminate duplicates Z: 17 29.410 2.179 0.631 0.814 1.000 0.562 CB 1.574 17 residues pruned to eliminate duplicates Z: 15 24.831 2.221 0.423 0.857 1.000 0.786 CB 1.547 15 residues pruned to eliminate duplicates Z: 13 20.696 2.104 1.281 0.522 0.833 0.750 CB 1.463 13 residues pruned to eliminate duplicates Z: 9 14.212 1.938 0.829 0.613 0.875 0.750 CB 1.456 10 residues pruned to eliminate duplicates Z: 15 25.909 2.089 0.692 0.930 1.000 0.929 CB 1.369 15 residues pruned to eliminate duplicates Z: 9 14.750 2.176 0.929 0.492 1.000 0.625 CB 1.253 9 residues pruned to eliminate duplicates Z: 17 35.023 2.044 0.986 0.946 1.000 0.875 CB 1.492 17 residues pruned to eliminate duplicates Z: 6 4.668 1.927 -0.136 0.701 1.000 0.600 CB 1.044 6 residues pruned to eliminate duplicates Z: 12 22.443 1.980 0.952 0.596 1.000 0.727 CB 1.598 12 residues pruned to eliminate duplicates Z: 14 13.976 1.809 0.476 0.926 1.000 0.846 CB 1.018 14 residues pruned to eliminate duplicates Z: 8 17.208 1.977 1.156 0.642 0.857 0.857 CA 1.560 8 residues pruned to eliminate duplicates Z: 39 30.972 2.063 0.904 0.619 0.868 0.737 CB 1.317 39 residues pruned to eliminate duplicates Z: 30 38.734 2.256 0.941 0.626 0.931 0.552 CB 1.567 30 residues pruned to eliminate duplicates Z: 20 43.023 2.271 0.850 0.933 1.000 0.842 CB 1.640 20 residues pruned to eliminate duplicates Z: 22 48.360 2.269 1.036 0.894 0.952 0.762 CB 1.720 22 residues pruned to eliminate duplicates Z: 38 59.359 2.319 1.008 0.868 0.946 0.730 CB 1.620 38 residues pruned to eliminate duplicates Z: 15 27.864 2.268 1.036 0.847 0.857 0.786 CB 1.396 15 residues pruned to eliminate duplicates Z: 8 17.876 2.235 1.168 0.703 0.857 0.857 CB 1.352 8 residues pruned to eliminate duplicates Z: 10 9.113 1.917 0.692 0.683 0.556 0.556 CB 1.424 10 residues pruned to eliminate duplicates Z: 17 25.588 1.949 0.747 0.920 1.000 0.812 CB 1.322 17 residues pruned to eliminate duplicates Z: 35 41.867 2.250 0.961 0.612 0.912 0.706 CB 1.605 35 residues pruned to eliminate duplicates Z: 14 40.198 2.306 1.224 0.836 1.000 0.538 CB 1.627 14 residues pruned to eliminate duplicates Z: 76 51.595 2.181 0.917 0.604 0.907 0.573 CB 1.423 76 residues pruned to eliminate duplicates Z: 34 31.097 2.102 1.014 0.472 0.939 0.545 CB 1.400 35 residues pruned to eliminate duplicates Z: 11 5.480 1.702 0.919 0.241 0.700 0.200 CB 1.023 11 residues pruned to eliminate duplicates Z: 14 27.288 2.170 0.746 0.923 1.000 0.923 CB 1.404 14 residues pruned to eliminate duplicates Z: 15 28.478 2.098 0.917 0.911 1.000 0.714 CB 1.341 15 residues pruned to eliminate duplicates Z: 26 26.900 2.040 0.925 0.651 0.920 0.680 CB 1.294 26 residues pruned to eliminate duplicates Z: 36 38.510 2.111 0.895 0.682 0.971 0.714 CB 1.417 36 residues pruned to eliminate duplicates Z: 83 51.725 2.183 0.875 0.555 0.902 0.598 CB 1.466 83 residues pruned to eliminate duplicates Z: 12 16.981 2.058 0.753 0.883 1.000 0.909 CB 1.026 Z: 15 27.654 2.045 0.921 0.943 1.000 0.857 CB 1.304 15 residues pruned to eliminate duplicates Z: 13 24.187 2.239 0.857 0.802 0.833 0.833 CB 1.549 13 residues pruned to eliminate duplicates Z: 16 11.246 1.868 0.878 0.436 0.733 0.400 CB 1.205 16 residues pruned to eliminate duplicates Z: 21 36.638 2.128 0.871 0.885 1.000 0.850 CB 1.486 21 residues pruned to eliminate duplicates Z: 21 33.748 2.231 0.755 0.876 0.950 0.800 CB 1.474 21 residues pruned to eliminate duplicates Z: 14 22.715 1.938 0.993 0.863 0.846 0.692 CA 1.414 14 residues pruned to eliminate duplicates Z: 82 53.017 2.266 0.757 0.595 0.938 0.593 CB 1.440 82 residues pruned to eliminate duplicates Z: 21 22.362 1.961 0.904 0.502 1.000 0.700 CB 1.336 21 residues pruned to eliminate duplicates Z: 6 16.599 2.125 0.574 0.877 1.000 1.000 CB 1.612 6 residues pruned to eliminate duplicates Z: 18 26.698 1.936 0.816 0.892 1.000 0.824 CB 1.323 18 residues pruned to eliminate duplicates Z: 14 24.085 2.147 0.956 0.542 1.000 0.769 CB 1.526 14 residues pruned to eliminate duplicates Z: 82 62.141 2.270 1.018 0.585 0.926 0.593 CB 1.500 82 residues pruned to eliminate duplicates Z: 60 42.682 2.136 0.901 0.641 0.881 0.678 CB 1.361 60 residues pruned to eliminate duplicates Z: 18 13.951 1.833 0.634 0.589 0.882 0.765 CB 1.175 18 residues pruned to eliminate duplicates Z: 16 13.781 1.817 0.488 0.454 1.000 0.600 CB 1.380 16 residues pruned to eliminate duplicates Z: 11 18.469 2.152 0.752 0.469 1.000 0.400 CB 1.598 12 residues pruned to eliminate duplicates Z: 18 29.889 2.011 0.743 0.926 1.000 1.000 CB 1.451 18 residues pruned to eliminate duplicates Z: 38 48.726 2.310 0.631 0.883 0.973 0.703 CB 1.581 38 residues pruned to eliminate duplicates Z: 8 10.759 1.797 0.538 0.884 0.857 0.714 CB 1.240 8 residues pruned to eliminate duplicates Z: 11 24.302 2.156 0.897 0.863 1.000 0.800 CB 1.379 11 residues pruned to eliminate duplicates Z: 26 36.681 2.242 1.044 0.589 0.920 0.720 CB 1.599 26 residues pruned to eliminate duplicates Z: 14 23.415 2.144 0.995 0.541 1.000 0.846 CB 1.458 14 residues pruned to eliminate duplicates Z: 6 4.847 1.691 0.210 0.542 0.800 0.800 CB 1.270 6 residues pruned to eliminate duplicates Z: 47 40.958 2.241 1.104 0.502 0.891 0.522 CB 1.434 47 residues pruned to eliminate duplicates Z: 32 33.490 2.217 0.863 0.585 0.935 0.581 CB 1.435 32 residues pruned to eliminate duplicates Z: 15 29.228 2.179 0.853 0.836 0.929 0.571 CB 1.559 15 residues pruned to eliminate duplicates Z: 12 10.953 1.837 0.766 0.866 1.000 0.818 CB 0.745 10 residues pruned to eliminate duplicates Z: 6 9.927 1.801 0.489 0.868 1.000 1.000 CB 1.211 6 residues pruned to eliminate duplicates Z: 13 27.139 2.245 0.680 0.868 0.917 0.750 CA 1.656 13 residues pruned to eliminate duplicates Z: 50 51.493 2.296 0.904 0.689 0.959 0.755 CB 1.475 50 residues pruned to eliminate duplicates Z: 14 27.607 2.243 0.748 0.865 0.923 0.692 CB 1.549 14 residues pruned to eliminate duplicates Z: 8 16.150 1.995 0.828 0.599 1.000 0.571 CA 1.523 8 residues pruned to eliminate duplicates Z: 11 14.795 1.942 0.784 0.592 0.900 0.700 CB 1.374 11 residues pruned to eliminate duplicates Z: 17 33.429 1.998 0.973 0.938 1.000 0.875 CB 1.475 17 residues pruned to eliminate duplicates Z: 16 13.528 1.884 0.600 0.839 0.867 0.733 CB 0.999 16 residues pruned to eliminate duplicates Z: 16 33.439 2.040 0.978 0.948 1.000 0.867 CB 1.478 16 residues pruned to eliminate duplicates Z: 19 15.169 1.807 0.731 0.443 0.889 0.667 CB 1.363 19 residues pruned to eliminate duplicates Z: 14 25.727 2.186 0.682 0.930 1.000 1.000 CB 1.357 14 residues pruned to eliminate duplicates Z: 59 44.711 2.154 0.923 0.601 0.931 0.655 CB 1.383 59 residues pruned to eliminate duplicates Z: 6 7.442 1.863 0.458 0.745 0.800 0.600 CA 1.230 6 residues pruned to eliminate duplicates Z: 13 13.676 1.844 0.599 0.874 1.000 0.917 CB 0.975 13 residues pruned to eliminate duplicates Z: 36 56.043 2.350 0.943 0.866 0.943 0.743 CB 1.610 36 residues pruned to eliminate duplicates Z: 99 60.851 2.205 1.064 0.564 0.898 0.561 CB 1.414 99 residues pruned to eliminate duplicates Z: 12 23.210 2.082 1.072 0.842 1.000 0.909 CB 1.209 12 residues pruned to eliminate duplicates Z: 8 5.917 1.802 -0.160 0.586 1.000 0.714 CB 1.361 Z: 6 5.761 1.361 0.672 0.564 1.000 0.600 CA 1.065 6 residues pruned to eliminate duplicates Z: 18 18.522 1.902 0.513 0.891 0.882 0.765 CB 1.272 18 residues pruned to eliminate duplicates Z: 18 25.534 2.180 0.525 0.848 1.000 0.882 CB 1.382 18 residues pruned to eliminate duplicates Z: 10 31.597 2.490 0.833 0.894 1.000 1.000 CA 1.656 10 residues pruned to eliminate duplicates Z: 19 32.411 1.972 0.886 0.903 1.000 0.889 CA 1.465 19 residues pruned to eliminate duplicates Z: 8 2.474 1.441 0.303 0.360 0.714 0.571 CB 0.811 8 residues pruned to eliminate duplicates Z: 7 5.842 1.795 0.306 0.633 0.833 0.667 CB 1.078 Z: 71 53.833 2.219 1.068 0.578 0.900 0.600 CB 1.445 71 residues pruned to eliminate duplicates Z: 19 18.325 1.965 0.999 0.409 0.889 0.500 CB 1.361 19 residues pruned to eliminate duplicates Z: 12 13.123 2.014 0.397 0.919 1.000 1.000 CB 0.991 12 residues pruned to eliminate duplicates Z: 81 60.191 2.287 0.890 0.599 0.938 0.625 CB 1.511 81 residues pruned to eliminate duplicates Z: 21 20.244 1.923 0.893 0.433 1.000 0.550 CB 1.332 21 residues pruned to eliminate duplicates Z: 15 8.717 1.964 0.546 0.164 0.786 0.429 CB 1.471 15 residues pruned to eliminate duplicates Z: 28 37.397 2.332 0.954 0.566 0.926 0.741 CB 1.601 28 residues pruned to eliminate duplicates Z: 15 15.548 1.774 0.503 0.935 1.000 0.857 CB 1.087 Z: 7 5.866 1.713 0.287 0.776 0.833 0.667 CB 1.022 7 residues pruned to eliminate duplicates Z: 40 29.953 2.155 0.903 0.373 0.897 0.513 CB 1.492 40 residues pruned to eliminate duplicates Z: 14 36.478 2.247 0.924 0.854 1.000 0.615 CB 1.728 14 residues pruned to eliminate duplicates Z: 9 6.504 1.878 0.594 0.218 0.750 0.500 CA 1.427 9 residues pruned to eliminate duplicates Z: 8 7.485 1.610 0.571 0.794 0.857 0.714 CB 1.008 8 residues pruned to eliminate duplicates Z: 21 42.852 2.197 1.056 0.929 0.950 0.750 CB 1.563 21 residues pruned to eliminate duplicates Z: 28 14.239 1.770 0.633 0.508 0.889 0.593 CB 1.059 28 residues pruned to eliminate duplicates Z: 12 29.085 2.223 0.804 0.926 1.000 0.818 CA 1.534 12 residues pruned to eliminate duplicates Z: 15 21.825 2.266 0.880 0.480 0.929 0.786 CB 1.504 18 residues pruned to eliminate duplicates Z: 13 33.349 2.310 0.967 0.854 1.000 0.667 CB 1.565 13 residues pruned to eliminate duplicates Z: 8 7.780 1.630 0.513 0.690 1.000 0.571 CB 1.002 8 residues pruned to eliminate duplicates Z: 19 21.042 1.905 0.880 0.556 1.000 0.833 CB 1.312 15 residues pruned to eliminate duplicates Z: 26 20.075 2.015 0.846 0.430 0.800 0.640 CB 1.451 26 residues pruned to eliminate duplicates Z: 31 33.522 2.289 1.035 0.513 0.867 0.500 CB 1.497 31 residues pruned to eliminate duplicates Z: 22 46.465 2.194 1.083 0.872 0.952 0.762 CB 1.697 22 residues pruned to eliminate duplicates Z: 15 25.222 2.186 0.881 0.863 0.929 0.929 CB 1.295 15 residues pruned to eliminate duplicates Z: 19 23.511 2.220 0.889 0.508 0.833 0.556 CB 1.573 19 residues pruned to eliminate duplicates Z: 15 14.874 1.786 0.407 0.936 1.000 1.000 CB 1.101 15 residues pruned to eliminate duplicates Z: 15 26.852 1.999 0.674 0.916 1.000 0.786 CB 1.515 15 residues pruned to eliminate duplicates Z: 28 15.741 1.837 0.674 0.492 0.889 0.667 CB 1.117 28 residues pruned to eliminate duplicates Z: 16 15.061 1.878 0.632 0.671 0.867 0.800 CB 1.250 16 residues pruned to eliminate duplicates Z: 17 17.443 1.942 0.816 0.517 0.812 0.625 CB 1.495 17 residues pruned to eliminate duplicates Z: 17 18.984 2.189 1.036 0.500 0.812 0.562 CB 1.310 13 residues pruned to eliminate duplicates Z: 17 32.377 2.071 1.011 0.838 1.000 0.562 CB 1.453 17 residues pruned to eliminate duplicates Z: 36 36.239 2.081 0.719 0.852 0.971 0.743 CB 1.303 36 residues pruned to eliminate duplicates Z: 6 2.322 1.576 0.505 0.347 0.600 0.600 C 0.861 6 residues pruned to eliminate duplicates Z: 36 35.517 2.047 0.910 0.666 0.914 0.743 CB 1.441 36 residues pruned to eliminate duplicates Z: 17 34.470 1.961 1.087 0.952 1.000 0.812 CB 1.450 17 residues pruned to eliminate duplicates Z: 12 22.673 1.999 0.750 0.838 1.000 0.727 CB 1.461 12 residues pruned to eliminate duplicates Z: 19 23.340 2.273 0.987 0.407 0.833 0.389 CB 1.612 19 residues pruned to eliminate duplicates Z: 15 23.556 2.100 0.566 0.919 1.000 0.929 CB 1.349 15 residues pruned to eliminate duplicates Z: 14 18.139 1.955 0.930 0.532 1.000 0.846 CB 1.291 14 residues pruned to eliminate duplicates Z: 7 7.681 2.000 0.716 0.422 0.833 0.500 CB 1.189 Z: 7 9.815 1.945 0.337 0.741 1.000 0.667 CB 1.241 7 residues pruned to eliminate duplicates Z: 31 34.164 2.173 1.032 0.611 0.900 0.467 CB 1.412 31 residues pruned to eliminate duplicates Z: 18 31.181 2.025 0.759 0.933 1.000 0.941 CA 1.482 18 residues pruned to eliminate duplicates Z: 56 51.082 2.268 0.824 0.630 0.964 0.673 CB 1.529 62 residues pruned to eliminate duplicates Z: 11 14.703 2.067 0.762 0.916 0.900 0.700 CB 1.002 11 residues pruned to eliminate duplicates Z: 17 23.435 1.911 0.564 0.923 1.000 0.812 CB 1.377 17 residues pruned to eliminate duplicates Z: 16 25.795 2.007 0.647 0.932 1.000 0.867 CB 1.407 16 residues pruned to eliminate duplicates Z: 6 8.215 1.656 1.187 0.606 0.800 0.600 CA 1.147 6 residues pruned to eliminate duplicates Z: 6 8.560 1.783 1.131 0.471 0.800 0.600 CB 1.296 6 residues pruned to eliminate duplicates Z: 9 13.947 2.062 1.162 0.675 0.750 0.750 CB 1.255 9 residues pruned to eliminate duplicates Z: 13 18.247 2.202 0.924 0.436 0.833 0.417 CA 1.594 13 residues pruned to eliminate duplicates Z: 59 37.050 1.993 0.899 0.614 0.931 0.672 CB 1.239 54 residues pruned to eliminate duplicates Z: 21 22.974 1.963 0.888 0.525 0.950 0.750 CB 1.423 21 residues pruned to eliminate duplicates Z: 19 9.027 1.852 0.652 0.513 0.722 0.389 CB 0.950 28 residues pruned to eliminate duplicates Z: 10 10.686 2.015 0.610 0.437 0.889 0.556 CB 1.318 10 residues pruned to eliminate duplicates Z: 98 63.748 2.193 1.061 0.580 0.938 0.649 CB 1.413 98 residues pruned to eliminate duplicates Z: 30 31.404 2.193 0.685 0.678 0.897 0.690 CB 1.494 30 residues pruned to eliminate duplicates Z: 6 9.431 1.718 0.898 0.808 1.000 0.600 CA 0.989 6 residues pruned to eliminate duplicates Z: 71 58.516 2.228 1.060 0.603 0.929 0.614 CB 1.488 141 residues pruned to eliminate duplicates Z: 51 30.315 1.992 0.752 0.521 0.900 0.500 CB 1.337 8 residues pruned to eliminate duplicates Z: 37 32.994 2.087 1.009 0.507 0.861 0.667 CB 1.513 37 residues pruned to eliminate duplicates Z: 40 37.434 2.019 1.026 0.634 0.923 0.590 CB 1.400 40 residues pruned to eliminate duplicates Z: 6 6.243 1.729 0.374 0.736 0.800 0.600 CB 1.188 6 residues pruned to eliminate duplicates Z: 16 7.411 1.804 0.461 0.367 0.733 0.467 CB 1.143 16 residues pruned to eliminate duplicates Z: 7 8.300 1.675 0.516 0.888 1.000 0.833 CB 0.962 7 residues pruned to eliminate duplicates Z: 28 32.728 2.311 0.827 0.559 0.889 0.741 CB 1.585 28 residues pruned to eliminate duplicates Z: 11 11.701 1.843 0.720 0.461 0.900 0.500 CB 1.350 11 residues pruned to eliminate duplicates Z: 15 26.080 2.238 0.846 0.803 0.857 0.571 CB 1.510 15 residues pruned to eliminate duplicates Z: 13 24.187 2.133 0.743 0.895 0.917 0.833 CB 1.469 13 residues pruned to eliminate duplicates Z: 22 29.815 2.115 0.781 0.866 0.905 0.667 CB 1.398 22 residues pruned to eliminate duplicates Z: 12 3.671 1.630 0.031 0.392 0.727 0.455 CB 1.015 Z: 18 32.614 1.978 0.978 0.935 1.000 0.588 CB 1.409 18 residues pruned to eliminate duplicates Z: 13 24.343 2.149 0.874 0.868 0.917 0.833 CB 1.392 13 residues pruned to eliminate duplicates Z: 6 2.904 1.680 -0.331 0.689 0.800 0.800 CB 1.214 Z: 6 6.395 1.749 0.481 0.606 1.000 0.400 CB 0.999 Z: 17 8.505 1.636 0.327 0.445 0.938 0.500 CB 1.105 17 residues pruned to eliminate duplicates Z: 18 31.797 1.987 0.845 0.895 1.000 0.882 CB 1.509 18 residues pruned to eliminate duplicates Z: 18 8.633 1.947 0.576 0.271 0.765 0.471 CB 1.157 18 residues pruned to eliminate duplicates Z: 32 39.161 2.172 1.036 0.526 0.968 0.613 CB 1.602 32 residues pruned to eliminate duplicates Z: 18 28.471 1.945 1.096 0.779 1.000 0.588 CB 1.325 18 residues pruned to eliminate duplicates Z: 13 17.417 2.039 0.341 0.933 0.833 0.667 CB 1.540 13 residues pruned to eliminate duplicates Z: 28 35.047 2.382 1.025 0.444 0.889 0.556 CB 1.666 28 residues pruned to eliminate duplicates Z: 111 60.345 2.187 1.045 0.542 0.882 0.573 CB 1.400 111 residues pruned to eliminate duplicates Z: 19 25.490 2.179 0.726 0.817 0.944 0.722 CB 1.285 19 residues pruned to eliminate duplicates Z: 31 42.859 2.230 1.084 0.541 1.000 0.467 CB 1.617 31 residues pruned to eliminate duplicates Z: 15 31.128 2.181 1.074 0.788 0.929 0.786 CA 1.537 15 residues pruned to eliminate duplicates Z: 32 35.147 2.062 0.914 0.665 0.903 0.710 CB 1.520 32 residues pruned to eliminate duplicates Z: 45 27.555 1.905 0.701 0.584 0.955 0.636 CB 1.239 45 residues pruned to eliminate duplicates Z: 22 47.821 2.268 1.031 0.898 0.952 0.571 CB 1.701 22 residues pruned to eliminate duplicates Z: 63 48.606 2.188 1.082 0.546 0.903 0.548 CB 1.435 63 residues pruned to eliminate duplicates Z: 57 50.629 2.146 1.096 0.626 0.893 0.607 CB 1.496 57 residues pruned to eliminate duplicates Z: 14 21.473 2.069 0.826 0.486 1.000 0.769 CA 1.600 14 residues pruned to eliminate duplicates Z: 21 37.075 2.175 0.692 0.922 1.000 0.900 CB 1.584 21 residues pruned to eliminate duplicates Z: 7 3.783 1.610 0.458 0.458 0.667 0.500 CB 1.029 Z: 13 9.947 1.889 0.717 0.410 0.667 0.500 CA 1.458 13 residues pruned to eliminate duplicates Z: 7 2.162 1.791 -0.361 0.523 1.000 0.500 CB 0.753 Z: 16 36.527 2.275 1.200 0.792 0.867 0.333 CB 1.683 16 residues pruned to eliminate duplicates Z: 15 36.128 2.144 1.104 0.849 1.000 0.643 CB 1.587 15 residues pruned to eliminate duplicates Z: 14 17.088 1.894 1.083 0.576 0.923 0.769 CB 1.210 14 residues pruned to eliminate duplicates Z: 6 9.407 1.941 1.007 0.495 0.800 0.600 C 1.358 Z: 13 15.456 1.882 0.506 0.941 1.000 0.750 CB 1.093 14 residues pruned to eliminate duplicates Z: 11 6.310 1.840 0.033 0.556 0.900 0.400 CB 1.104 12 residues pruned to eliminate duplicates Z: 21 22.739 1.985 0.882 0.490 1.000 0.650 CB 1.374 21 residues pruned to eliminate duplicates Z: 34 39.496 2.268 0.996 0.532 0.970 0.576 CB 1.518 34 residues pruned to eliminate duplicates Z: 13 13.609 1.976 0.754 0.419 0.833 0.583 CB 1.479 13 residues pruned to eliminate duplicates Z: 17 31.195 2.046 1.103 0.844 1.000 0.750 CB 1.349 17 residues pruned to eliminate duplicates Z: 68 46.646 2.181 0.864 0.580 0.910 0.597 CB 1.426 68 residues pruned to eliminate duplicates Z: 11 17.638 2.045 0.854 0.809 0.800 0.700 CB 1.405 11 residues pruned to eliminate duplicates Z: 13 12.667 1.852 0.364 0.923 0.917 0.833 CB 1.110 13 residues pruned to eliminate duplicates 6 1.217 1.434 -0.298 0.474 0.800 0.600 CB 0.694 ? Z: 17 28.482 2.032 0.651 0.935 1.000 0.875 CB 1.479 17 residues pruned to eliminate duplicates Z: 14 16.555 1.874 0.944 0.575 0.923 0.769 CB 1.270 14 residues pruned to eliminate duplicates Z: 43 30.933 2.019 0.928 0.604 0.857 0.548 CB 1.296 43 residues pruned to eliminate duplicates Z: 35 42.570 2.248 1.072 0.612 0.912 0.559 CB 1.546 35 residues pruned to eliminate duplicates Z: 28 13.951 1.849 0.565 0.490 0.815 0.556 CB 1.151 28 residues pruned to eliminate duplicates Z: 99 57.465 2.183 0.930 0.563 0.918 0.643 CB 1.411 99 residues pruned to eliminate duplicates Z: 15 13.290 1.785 0.420 0.909 1.000 0.929 CB 0.995 15 residues pruned to eliminate duplicates Z: 27 34.921 2.257 1.114 0.449 0.923 0.423 CB 1.638 27 residues pruned to eliminate duplicates Z: 68 41.160 2.126 0.891 0.546 0.896 0.642 CB 1.335 68 residues pruned to eliminate duplicates Z: 39 44.019 2.173 0.678 0.856 0.974 0.684 CB 1.483 39 residues pruned to eliminate duplicates Z: 20 34.147 2.374 0.796 0.624 0.947 0.579 CB 1.725 20 residues pruned to eliminate duplicates Z: 14 34.050 2.223 1.222 0.838 1.000 0.846 CB 1.429 14 residues pruned to eliminate duplicates Z: 16 33.507 2.123 1.109 0.857 1.000 0.533 CB 1.423 16 residues pruned to eliminate duplicates Z: 6 5.725 1.467 0.466 0.628 1.000 0.800 O 1.055 Z: 11 27.529 2.259 1.011 0.899 0.900 0.900 CB 1.522 11 residues pruned to eliminate duplicates Z: 15 17.754 2.050 0.679 0.426 0.929 0.500 CB 1.603 15 residues pruned to eliminate duplicates Z: 19 14.584 1.874 0.635 0.437 0.889 0.611 CB 1.347 19 residues pruned to eliminate duplicates Z: 14 7.456 1.985 0.562 0.280 0.769 0.462 CB 1.112 14 residues pruned to eliminate duplicates Z: 74 50.492 2.192 0.927 0.578 0.932 0.616 CB 1.393 74 residues pruned to eliminate duplicates Z: 12 10.491 1.890 0.694 0.849 0.909 0.727 CB 0.806 12 residues pruned to eliminate duplicates Z: 12 30.570 2.124 1.235 0.912 0.909 0.818 CB 1.513 12 residues pruned to eliminate duplicates Z: 7 2.558 1.578 -0.202 0.396 0.833 0.667 CB 1.111 Z: 21 38.588 2.194 0.851 0.925 1.000 0.800 CB 1.492 21 residues pruned to eliminate duplicates Z: 14 20.289 1.910 1.154 0.530 0.923 0.538 CB 1.440 Z: 16 41.582 2.201 1.290 0.877 1.000 0.800 CA 1.547 16 residues pruned to eliminate duplicates Z: 37 41.261 2.199 0.970 0.593 0.889 0.667 CB 1.633 36 residues pruned to eliminate duplicates Z: 17 33.116 2.072 0.820 0.943 1.000 0.938 CB 1.521 17 residues pruned to eliminate duplicates Z: 36 34.857 2.076 0.663 0.852 0.943 0.743 CB 1.338 36 residues pruned to eliminate duplicates Z: 13 9.926 1.716 0.926 0.447 0.750 0.417 CB 1.222 13 residues pruned to eliminate duplicates Z: 21 18.125 1.818 0.893 0.533 0.950 0.650 CB 1.200 21 residues pruned to eliminate duplicates Z: 22 35.038 2.206 0.795 0.861 0.952 0.667 CB 1.489 22 residues pruned to eliminate duplicates Z: 24 27.222 2.227 0.735 0.522 0.913 0.652 CB 1.574 24 residues pruned to eliminate duplicates Z: 12 24.441 2.150 0.599 0.918 1.000 0.909 CA 1.512 12 residues pruned to eliminate duplicates Z: 15 14.247 1.914 0.598 0.386 0.929 0.500 CB 1.513 15 residues pruned to eliminate duplicates Z: 16 31.582 2.204 0.820 0.860 1.000 0.733 CB 1.495 16 residues pruned to eliminate duplicates Z: 16 23.753 2.129 0.814 0.719 0.867 0.600 CB 1.503 16 residues pruned to eliminate duplicates Z: 6 7.165 1.817 0.532 0.858 0.800 0.800 CA 1.060 6 residues pruned to eliminate duplicates Z: 17 33.020 1.974 0.943 0.954 1.000 0.938 CB 1.479 17 residues pruned to eliminate duplicates Z: 36 35.334 2.201 0.741 0.598 0.914 0.657 CB 1.553 36 residues pruned to eliminate duplicates Z: 15 18.191 1.919 0.924 0.487 0.929 0.571 CB 1.437 Z: 22 16.393 1.890 0.873 0.376 0.905 0.619 CB 1.276 22 residues pruned to eliminate duplicates Z: 16 29.543 2.026 0.742 0.942 1.000 0.800 CB 1.499 16 residues pruned to eliminate duplicates Z: 36 31.448 2.004 0.898 0.603 0.943 0.686 CB 1.345 36 residues pruned to eliminate duplicates Z: 63 42.714 2.157 0.867 0.555 0.903 0.629 CB 1.414 63 residues pruned to eliminate duplicates Z: 26 32.810 2.308 0.820 0.540 0.880 0.560 CB 1.706 26 residues pruned to eliminate duplicates Z: 40 26.345 2.015 0.755 0.598 0.846 0.667 CB 1.284 40 residues pruned to eliminate duplicates Z: 20 16.076 1.997 0.890 0.500 0.789 0.474 CB 1.238 20 residues pruned to eliminate duplicates Z: 13 15.368 1.942 0.745 0.513 0.833 0.667 CB 1.551 13 residues pruned to eliminate duplicates Z: 7 11.635 1.654 0.961 0.723 1.000 0.667 CB 1.198 Z: 13 21.115 1.956 1.063 0.619 1.000 0.750 CB 1.351 13 residues pruned to eliminate duplicates Z: 44 32.244 2.114 0.947 0.534 0.860 0.581 CB 1.343 44 residues pruned to eliminate duplicates Z: 40 32.014 1.987 1.009 0.595 0.872 0.590 CB 1.345 40 residues pruned to eliminate duplicates Z: 18 30.146 1.950 0.939 0.916 1.000 0.706 CB 1.366 18 residues pruned to eliminate duplicates Z: 14 21.867 2.007 0.593 0.839 1.000 0.846 CB 1.416 14 residues pruned to eliminate duplicates Z: 10 17.017 2.004 0.754 0.638 1.000 0.667 CB 1.417 10 residues pruned to eliminate duplicates Z: 6 9.906 1.782 0.501 0.721 1.000 1.000 CB 1.357 6 residues pruned to eliminate duplicates Z: 7 5.412 1.847 -0.091 0.498 1.000 0.667 CB 1.318 5 residues pruned to eliminate duplicates Z: 40 36.432 2.046 0.784 0.669 0.949 0.718 CB 1.441 55 residues pruned to eliminate duplicates Z: 27 24.384 2.243 0.965 0.350 0.808 0.423 CB 1.581 27 residues pruned to eliminate duplicates Z: 7 11.941 1.726 0.855 0.630 1.000 0.500 CB 1.347 Z: 26 17.210 1.850 0.529 0.535 0.960 0.720 CB 1.225 26 residues pruned to eliminate duplicates Z: 8 9.410 1.755 0.312 0.912 1.000 0.571 CB 1.094 7 residues pruned to eliminate duplicates Z: 9 5.698 1.647 0.725 0.437 0.875 0.500 CB 0.865 9 residues pruned to eliminate duplicates Z: 17 32.322 1.983 0.851 0.950 1.000 1.000 CB 1.518 17 residues pruned to eliminate duplicates Z: 123 51.486 2.086 0.738 0.575 0.877 0.664 CB 1.364 127 residues pruned to eliminate duplicates Z: 27 25.173 2.053 0.821 0.527 0.962 0.692 CB 1.336 27 residues pruned to eliminate duplicates Z: 15 27.476 2.184 0.839 0.858 0.929 0.786 CB 1.450 15 residues pruned to eliminate duplicates Z: 59 43.340 2.134 0.947 0.598 0.931 0.724 CB 1.340 59 residues pruned to eliminate duplicates Z: 30 24.198 2.159 0.679 0.458 0.862 0.517 CB 1.501 30 residues pruned to eliminate duplicates Z: 8 9.412 1.669 0.852 0.453 0.857 0.429 N 1.409 8 residues pruned to eliminate duplicates Z: 20 13.817 1.983 0.560 0.476 0.895 0.632 CB 1.173 20 residues pruned to eliminate duplicates Z: 10 9.831 1.771 0.503 0.679 0.889 0.556 CB 1.175 10 residues pruned to eliminate duplicates Z: 10 6.692 1.925 0.219 0.376 0.778 0.667 CB 1.396 10 residues pruned to eliminate duplicates Z: 6 2.078 1.567 -0.470 0.601 1.000 0.800 N 1.016 Z: 14 11.061 2.174 0.725 0.303 0.692 0.385 CB 1.472 14 residues pruned to eliminate duplicates Z: 8 12.896 1.966 1.213 0.798 1.000 0.857 CB 0.863 Z: 14 23.196 2.125 0.808 0.909 0.923 0.923 CB 1.287 14 residues pruned to eliminate duplicates Z: 18 29.415 1.927 0.952 0.891 1.000 0.706 CB 1.363 18 residues pruned to eliminate duplicates Z: 13 7.631 1.938 0.640 0.233 0.667 0.417 CA 1.419 19 residues pruned to eliminate duplicates Z: 19 42.594 2.347 1.291 0.711 0.944 0.611 CB 1.633 19 residues pruned to eliminate duplicates Z: 22 32.875 2.047 1.132 0.774 0.952 0.714 CB 1.355 22 residues pruned to eliminate duplicates Z: 80 55.619 2.253 0.814 0.633 0.924 0.620 CB 1.463 80 residues pruned to eliminate duplicates Z: 12 13.767 1.969 0.574 0.756 0.909 0.545 CB 1.173 12 residues pruned to eliminate duplicates Z: 64 42.361 2.014 0.920 0.614 0.905 0.635 CB 1.370 64 residues pruned to eliminate duplicates Z: 17 26.170 2.047 0.519 0.955 1.000 1.000 CB 1.446 17 residues pruned to eliminate duplicates Z: 30 33.284 1.989 1.046 0.689 0.931 0.759 CB 1.372 30 residues pruned to eliminate duplicates Z: 12 15.531 1.856 0.925 0.591 0.818 0.636 CB 1.469 12 residues pruned to eliminate duplicates Z: 8 3.218 1.596 0.216 0.296 0.857 0.429 CB 0.919 8 residues pruned to eliminate duplicates Z: 6 13.501 1.832 1.318 0.665 0.800 0.800 CA 1.525 6 residues pruned to eliminate duplicates Z: 106 50.412 2.098 0.901 0.544 0.895 0.533 CB 1.321 106 residues pruned to eliminate duplicates Z: 19 19.666 1.890 0.861 0.540 0.944 0.778 CB 1.342 19 residues pruned to eliminate duplicates Z: 94 51.225 2.104 0.875 0.589 0.925 0.591 CB 1.337 94 residues pruned to eliminate duplicates Z: 25 25.206 2.258 0.563 0.460 0.917 0.458 CB 1.657 25 residues pruned to eliminate duplicates Z: 20 22.600 2.029 0.723 0.556 1.000 0.684 CB 1.404 20 residues pruned to eliminate duplicates Z: 45 34.808 2.092 0.813 0.629 0.932 0.591 CB 1.314 45 residues pruned to eliminate duplicates Z: 59 44.199 2.146 0.941 0.597 0.931 0.672 CB 1.365 59 residues pruned to eliminate duplicates Z: 31 31.463 2.179 0.928 0.603 0.833 0.600 CB 1.488 31 residues pruned to eliminate duplicates Z: 27 31.676 2.173 0.924 0.656 0.923 0.615 CB 1.392 27 residues pruned to eliminate duplicates Z: 30 39.044 2.342 0.994 0.555 0.897 0.621 CB 1.641 30 residues pruned to eliminate duplicates Z: 56 47.228 2.243 0.985 0.564 0.909 0.564 CB 1.479 56 residues pruned to eliminate duplicates Z: 30 23.230 1.961 0.862 0.503 0.931 0.724 CB 1.265 32 residues pruned to eliminate duplicates Z: 15 11.553 1.713 0.117 0.939 1.000 1.000 CB 1.121 15 residues pruned to eliminate duplicates Z: 17 15.101 2.166 0.862 0.357 0.875 0.312 CB 1.248 17 residues pruned to eliminate duplicates Z: 29 29.343 2.326 1.003 0.406 0.893 0.429 CB 1.470 29 residues pruned to eliminate duplicates Z: 6 6.021 1.578 0.836 0.458 1.000 0.400 CB 0.970 6 residues pruned to eliminate duplicates Z: 31 40.075 2.256 0.927 0.613 0.933 0.767 CB 1.620 31 residues pruned to eliminate duplicates Z: 16 21.818 1.995 0.464 0.900 0.933 0.800 CB 1.476 16 residues pruned to eliminate duplicates Z: 15 22.692 2.062 0.445 0.934 1.000 0.929 CB 1.419 15 residues pruned to eliminate duplicates Z: 17 23.528 1.949 0.462 0.930 1.000 0.875 CB 1.443 17 residues pruned to eliminate duplicates Z: 10 24.280 2.364 0.864 0.568 1.000 0.889 CB 1.720 10 residues pruned to eliminate duplicates Z: 14 17.722 1.808 0.656 0.929 1.000 0.692 CB 1.149 14 residues pruned to eliminate duplicates Z: 21 21.755 1.964 0.837 0.506 1.000 0.700 CB 1.340 21 residues pruned to eliminate duplicates Z: 30 38.614 2.421 1.017 0.445 0.897 0.552 CB 1.734 30 residues pruned to eliminate duplicates Z: 15 21.029 2.037 0.760 0.461 1.000 0.714 CA 1.631 15 residues pruned to eliminate duplicates Z: 9 8.890 1.914 0.760 0.436 0.750 0.250 CB 1.330 9 residues pruned to eliminate duplicates Z: 10 9.841 1.823 0.134 0.771 1.000 0.778 CB 1.249 10 residues pruned to eliminate duplicates Z: 17 20.574 1.924 0.320 0.917 1.000 0.875 CA 1.429 17 residues pruned to eliminate duplicates Z: 18 16.067 2.022 0.641 0.501 0.882 0.647 CB 1.331 18 residues pruned to eliminate duplicates Z: 7 17.325 2.000 1.023 0.761 1.000 0.667 CB 1.386 7 residues pruned to eliminate duplicates Z: 8 7.540 1.925 0.869 0.474 0.714 0.571 CB 1.138 Z: 12 12.086 1.838 0.625 0.927 0.909 0.818 CB 0.940 12 residues pruned to eliminate duplicates Z: 9 12.975 1.977 0.555 0.809 0.875 0.750 CB 1.303 9 residues pruned to eliminate duplicates Z: 6 2.199 1.590 -0.034 0.463 1.000 0.400 CB 0.665 Z: 29 39.544 2.226 0.834 0.685 0.964 0.821 CB 1.602 29 residues pruned to eliminate duplicates Z: 33 26.894 2.132 0.646 0.567 0.938 0.594 CB 1.354 33 residues pruned to eliminate duplicates Z: 9 10.579 2.108 0.724 0.443 0.875 0.625 CB 1.248 9 residues pruned to eliminate duplicates Z: 15 12.206 1.850 0.507 0.366 0.857 0.500 CB 1.577 Z: 21 39.263 2.289 0.870 0.667 1.000 0.900 CA 1.759 21 residues pruned to eliminate duplicates Z: 6 3.892 1.408 0.541 0.492 0.800 0.800 CB 1.011 Z: 25 30.241 2.274 0.687 0.576 0.958 0.625 CB 1.561 25 residues pruned to eliminate duplicates Z: 34 38.470 2.125 0.704 0.855 0.970 0.697 CB 1.408 51 residues pruned to eliminate duplicates Z: 81 48.383 2.086 0.896 0.631 0.925 0.600 CB 1.307 81 residues pruned to eliminate duplicates Z: 6 3.678 1.529 0.738 0.275 0.600 0.400 C 1.331 7 1.892 1.598 0.448 0.323 0.500 0.333 CB 0.811 ? Z: 9 12.430 2.090 0.751 0.308 0.875 0.500 N 1.699 9 residues pruned to eliminate duplicates Z: 6 3.325 1.714 0.115 0.440 0.600 0.400 CA 1.379 Z: 20 14.060 1.722 0.741 0.477 0.947 0.684 CB 1.163 20 residues pruned to eliminate duplicates Z: 33 38.788 2.218 0.884 0.566 0.969 0.750 CB 1.590 33 residues pruned to eliminate duplicates Z: 40 36.603 2.042 1.015 0.642 0.897 0.692 CB 1.389 40 residues pruned to eliminate duplicates Z: 37 37.524 2.070 0.812 0.861 0.917 0.667 CB 1.337 37 residues pruned to eliminate duplicates Z: 34 24.905 2.028 0.815 0.511 0.848 0.545 CB 1.374 34 residues pruned to eliminate duplicates Z: 109 53.346 2.076 0.756 0.640 0.917 0.639 CB 1.348 99 residues pruned to eliminate duplicates Z: 36 34.563 2.104 0.816 0.862 0.829 0.657 CB 1.355 36 residues pruned to eliminate duplicates Z: 9 16.551 2.051 0.873 0.596 0.875 0.750 C 1.590 9 residues pruned to eliminate duplicates Z: 27 25.295 2.288 0.800 0.364 0.846 0.385 CB 1.648 27 residues pruned to eliminate duplicates Z: 20 39.669 2.366 0.933 0.869 0.842 0.684 CB 1.726 20 residues pruned to eliminate duplicates Z: 16 11.928 1.631 0.516 0.894 0.933 0.733 CB 0.958 16 residues pruned to eliminate duplicates Z: 19 20.827 1.979 0.907 0.639 0.889 0.556 CB 1.285 19 residues pruned to eliminate duplicates Z: 14 15.421 1.803 0.702 0.913 0.923 0.615 CB 1.069 14 residues pruned to eliminate duplicates Z: 16 17.430 1.980 0.879 0.533 0.867 0.667 CB 1.351 16 residues pruned to eliminate duplicates Z: 22 15.016 1.750 0.960 0.450 0.905 0.524 CB 1.111 23 residues pruned to eliminate duplicates Z: 29 44.864 2.313 0.924 0.701 0.964 0.679 CB 1.645 29 residues pruned to eliminate duplicates Z: 6 5.288 1.803 0.531 0.378 0.600 0.200 CB 1.626 6 residues pruned to eliminate duplicates Z: 21 22.329 1.855 0.937 0.530 1.000 0.650 CB 1.349 20 residues pruned to eliminate duplicates Z: 116 68.121 2.201 0.882 0.642 0.896 0.687 CB 1.500 116 residues pruned to eliminate duplicates Z: 19 34.098 2.226 1.025 0.728 0.889 0.722 CA 1.633 19 residues pruned to eliminate duplicates Z: 16 21.850 2.004 0.441 0.926 1.000 0.800 CA 1.370 16 residues pruned to eliminate duplicates Z: 12 10.441 2.048 0.524 0.353 0.818 0.364 CB 1.445 12 residues pruned to eliminate duplicates Z: 6 2.301 1.594 0.538 0.282 0.600 0.400 CB 0.894 6 residues pruned to eliminate duplicates Z: 7 6.000 1.518 0.584 0.562 0.833 0.667 C 1.151 7 residues pruned to eliminate duplicates Z: 45 39.548 2.160 0.940 0.599 0.886 0.636 CB 1.460 45 residues pruned to eliminate duplicates Z: 15 40.483 2.292 1.198 0.918 0.929 0.929 CA 1.632 15 residues pruned to eliminate duplicates Z: 45 36.381 2.100 0.886 0.582 0.909 0.682 CB 1.408 45 residues pruned to eliminate duplicates Z: 46 37.221 2.190 0.952 0.489 0.867 0.556 CB 1.515 46 residues pruned to eliminate duplicates Z: 25 30.062 2.066 0.969 0.601 0.958 0.708 CB 1.430 24 residues pruned to eliminate duplicates Z: 8 10.706 2.153 0.685 0.143 1.000 0.429 CB 1.734 8 residues pruned to eliminate duplicates Z: 14 12.277 1.792 0.110 0.935 1.000 1.000 CB 1.193 14 residues pruned to eliminate duplicates Z: 93 59.754 2.195 0.949 0.556 0.957 0.598 CB 1.442 93 residues pruned to eliminate duplicates Z: 38 32.061 2.141 1.075 0.498 0.865 0.541 CB 1.375 38 residues pruned to eliminate duplicates Z: 13 10.213 1.613 0.477 0.639 1.000 0.667 CB 1.086 13 residues pruned to eliminate duplicates Z: 17 28.368 1.951 0.768 0.949 1.000 0.875 CB 1.418 17 residues pruned to eliminate duplicates Z: 7 5.149 1.594 0.538 0.508 1.000 0.333 N 0.851 4 residues pruned to eliminate duplicates Z: 26 38.115 2.329 1.074 0.547 0.920 0.680 CB 1.639 26 residues pruned to eliminate duplicates Z: 8 5.618 1.935 0.361 0.418 0.714 0.571 CB 1.229 8 residues pruned to eliminate duplicates Z: 25 29.201 2.288 0.622 0.547 0.958 0.583 CA 1.601 25 residues pruned to eliminate duplicates Z: 54 39.653 2.102 0.951 0.555 0.906 0.585 CB 1.390 54 residues pruned to eliminate duplicates Z: 9 2.896 1.736 -0.271 0.488 1.000 0.250 CB 0.818 Z: 14 13.992 1.802 0.625 0.651 0.923 0.846 CB 1.247 14 residues pruned to eliminate duplicates Z: 20 53.709 2.370 1.185 0.926 1.000 0.842 CA 1.668 20 residues pruned to eliminate duplicates Z: 22 48.322 2.342 1.030 0.836 0.952 0.810 CB 1.743 22 residues pruned to eliminate duplicates Z: 15 21.286 2.035 0.666 0.933 1.000 0.929 CB 1.171 15 residues pruned to eliminate duplicates Z: 19 23.908 1.941 0.996 0.551 1.000 0.722 CB 1.383 19 residues pruned to eliminate duplicates Z: 13 18.833 2.019 0.865 0.538 0.917 0.667 CB 1.517 13 residues pruned to eliminate duplicates Z: 22 46.719 2.292 1.020 0.845 0.952 0.810 CB 1.720 22 residues pruned to eliminate duplicates Z: 39 35.216 2.178 1.001 0.487 0.842 0.553 CB 1.576 39 residues pruned to eliminate duplicates Z: 9 4.326 1.570 0.373 0.282 0.750 0.625 CB 1.211 Z: 69 57.353 2.183 1.032 0.621 0.941 0.529 CB 1.487 72 residues pruned to eliminate duplicates Z: 14 10.840 1.780 0.319 0.904 1.000 0.923 CB 0.912 14 residues pruned to eliminate duplicates 6 1.803 1.392 -0.095 0.228 0.800 0.200 CB 1.100 ? Z: 33 32.645 2.164 0.746 0.563 0.906 0.719 CB 1.585 33 residues pruned to eliminate duplicates Z: 16 13.704 1.821 0.524 0.897 0.733 0.400 CB 1.245 16 residues pruned to eliminate duplicates Z: 23 18.226 1.858 0.775 0.435 0.955 0.545 CB 1.320 22 residues pruned to eliminate duplicates Z: 15 12.993 1.758 0.246 0.933 1.000 1.000 CB 1.106 15 residues pruned to eliminate duplicates Z: 23 37.156 2.234 0.983 0.697 0.909 0.727 CA 1.644 23 residues pruned to eliminate duplicates Z: 17 26.970 1.874 1.083 0.943 0.938 0.500 CB 1.277 17 residues pruned to eliminate duplicates Z: 18 24.699 2.052 0.902 0.621 0.941 0.706 CB 1.456 18 residues pruned to eliminate duplicates Z: 20 18.066 1.826 0.684 0.529 0.895 0.632 CB 1.464 20 residues pruned to eliminate duplicates Z: 40 29.846 2.018 0.866 0.582 0.897 0.692 CB 1.308 40 residues pruned to eliminate duplicates Z: 8 2.939 1.710 -0.045 0.471 0.857 0.571 CB 0.817 5 residues pruned to eliminate duplicates Z: 15 14.309 1.771 0.377 0.914 1.000 0.929 CB 1.109 15 residues pruned to eliminate duplicates Z: 13 35.934 2.315 1.045 0.895 1.000 1.000 CA 1.571 13 residues pruned to eliminate duplicates Z: 6 3.196 1.597 0.659 0.295 0.800 0.800 CB 0.848 Z: 22 18.280 1.982 0.677 0.515 0.905 0.810 CB 1.307 22 residues pruned to eliminate duplicates Z: 17 13.660 1.881 0.488 0.798 0.938 0.500 CB 1.003 17 residues pruned to eliminate duplicates Z: 8 2.259 1.477 0.191 0.388 0.857 0.571 CB 0.638 Z: 6 3.344 1.638 -0.086 0.371 0.800 0.400 O 1.433 Z: 9 3.270 1.433 0.415 0.346 0.625 0.500 O 1.078 9 residues pruned to eliminate duplicates Z: 19 42.942 2.373 0.987 0.813 0.944 0.778 CA 1.731 19 residues pruned to eliminate duplicates Z: 23 21.989 1.894 0.914 0.499 1.000 0.591 CB 1.294 23 residues pruned to eliminate duplicates Z: 35 49.478 2.326 0.870 0.864 0.941 0.735 CB 1.519 35 residues pruned to eliminate duplicates Z: 15 18.661 2.093 0.619 0.708 0.857 0.714 CB 1.422 15 residues pruned to eliminate duplicates Z: 10 17.082 1.983 0.762 0.630 1.000 0.556 CB 1.441 10 residues pruned to eliminate duplicates 6 1.650 1.640 0.772 0.440 0.600 0.600 N 0.450 ? Z: 11 4.929 1.530 0.597 0.302 0.700 0.300 CB 1.137 Z: 21 13.592 1.852 0.776 0.394 0.850 0.600 CB 1.215 21 residues pruned to eliminate duplicates Z: 10 9.887 2.078 0.461 0.264 0.889 0.333 CB 1.598 10 residues pruned to eliminate duplicates Z: 15 10.195 1.716 0.042 0.920 1.000 1.000 CB 1.073 14 residues pruned to eliminate duplicates Z: 21 19.711 1.884 1.006 0.520 0.800 0.550 CB 1.430 21 residues pruned to eliminate duplicates Z: 6 3.816 1.796 0.309 0.626 0.800 0.800 CA 0.806 6 residues pruned to eliminate duplicates Z: 26 26.757 2.034 0.826 0.542 1.000 0.680 CB 1.383 26 residues pruned to eliminate duplicates Z: 16 24.105 2.023 1.250 0.617 1.000 0.667 CB 1.224 16 residues pruned to eliminate duplicates Z: 51 49.749 2.225 0.854 0.650 0.960 0.700 CB 1.544 51 residues pruned to eliminate duplicates Z: 6 2.490 1.673 -0.317 0.678 1.000 0.800 CB 0.827 Z: 73 45.491 2.059 0.913 0.561 0.931 0.639 CB 1.378 72 residues pruned to eliminate duplicates Z: 11 4.216 1.512 0.614 0.321 0.800 0.700 N 0.832 Z: 22 20.049 1.946 0.854 0.502 0.905 0.619 CB 1.338 22 residues pruned to eliminate duplicates Z: 12 6.036 1.828 0.273 0.218 0.727 0.545 CB 1.497 12 residues pruned to eliminate duplicates Z: 33 32.259 2.145 1.003 0.565 0.812 0.594 CB 1.533 33 residues pruned to eliminate duplicates Z: 26 33.953 2.238 0.781 0.607 0.960 0.640 CB 1.603 26 residues pruned to eliminate duplicates Z: 8 8.233 1.653 0.561 0.764 0.857 0.857 CB 1.113 8 residues pruned to eliminate duplicates Z: 8 6.283 1.553 0.868 0.502 0.857 0.571 CA 0.954 8 residues pruned to eliminate duplicates Z: 26 23.153 2.092 0.482 0.629 0.920 0.680 CB 1.437 26 residues pruned to eliminate duplicates Z: 8 15.160 2.016 1.028 0.643 0.857 0.714 CB 1.430 8 residues pruned to eliminate duplicates Z: 12 5.512 1.556 0.125 0.451 0.818 0.273 CB 1.220 Z: 19 47.018 2.243 1.136 0.930 1.000 0.944 CB 1.618 19 residues pruned to eliminate duplicates Z: 31 44.369 2.372 1.010 0.566 0.967 0.700 CB 1.650 32 residues pruned to eliminate duplicates Z: 18 33.082 2.132 0.871 0.922 1.000 0.647 CB 1.415 18 residues pruned to eliminate duplicates Z: 12 13.202 1.856 0.399 0.911 1.000 0.818 CB 1.086 12 residues pruned to eliminate duplicates Z: 51 39.245 2.103 0.978 0.576 0.880 0.580 CB 1.409 51 residues pruned to eliminate duplicates Z: 7 5.302 1.752 0.241 0.436 0.833 0.500 N 1.277 7 residues pruned to eliminate duplicates Z: 20 11.889 1.857 0.373 0.445 0.842 0.474 CB 1.344 20 residues pruned to eliminate duplicates Z: 15 8.750 1.878 0.507 0.373 0.786 0.286 CB 1.205 15 residues pruned to eliminate duplicates Z: 26 31.919 2.102 1.310 0.561 0.880 0.560 CB 1.408 26 residues pruned to eliminate duplicates Z: 15 20.329 2.038 0.929 0.467 0.929 0.714 CB 1.539 15 residues pruned to eliminate duplicates 7 1.434 1.380 0.588 0.248 0.667 0.500 CB 0.535 ? Z: 8 6.287 1.619 0.492 0.692 1.000 0.429 CA 0.825 8 residues pruned to eliminate duplicates Z: 15 12.249 1.701 0.221 0.913 1.000 0.857 CB 1.116 15 residues pruned to eliminate duplicates Z: 60 42.567 2.081 0.876 0.594 0.898 0.678 CB 1.445 60 residues pruned to eliminate duplicates Z: 17 27.646 1.941 0.700 0.956 1.000 0.750 CB 1.439 17 residues pruned to eliminate duplicates Z: 22 37.756 2.336 1.049 0.599 0.905 0.762 CB 1.732 22 residues pruned to eliminate duplicates Z: 15 26.412 2.056 0.756 0.932 1.000 0.929 CB 1.365 15 residues pruned to eliminate duplicates Z: 87 46.900 2.116 0.906 0.527 0.872 0.651 CB 1.400 87 residues pruned to eliminate duplicates Z: 22 15.733 1.975 0.677 0.384 0.857 0.571 CB 1.368 12 residues pruned to eliminate duplicates Z: 16 19.003 1.960 0.229 0.938 1.000 0.867 CB 1.416 16 residues pruned to eliminate duplicates Z: 13 31.518 2.109 0.813 0.934 1.000 0.917 CA 1.659 13 residues pruned to eliminate duplicates Z: 17 14.083 2.006 0.798 0.297 0.812 0.438 CB 1.508 17 residues pruned to eliminate duplicates Z: 6 5.840 1.872 0.169 0.749 1.000 1.000 CB 0.955 7 residues pruned to eliminate duplicates Z: 35 22.902 2.112 0.580 0.492 0.882 0.559 CB 1.344 35 residues pruned to eliminate duplicates Z: 10 6.807 1.623 0.817 0.436 0.889 0.667 CB 0.924 12 residues pruned to eliminate duplicates Z: 8 13.459 1.954 0.811 0.674 1.000 1.000 CB 1.224 8 residues pruned to eliminate duplicates Z: 11 5.261 2.002 0.722 0.149 0.700 0.300 CB 1.062 11 residues pruned to eliminate duplicates Z: 8 14.937 1.777 1.063 0.899 0.857 0.714 CB 1.284 8 residues pruned to eliminate duplicates Z: 7 5.224 1.741 0.747 0.385 0.833 0.667 CB 0.951 Z: 9 2.011 1.713 0.032 0.311 0.750 0.625 CB 0.662 Z: 18 12.087 1.919 0.801 0.252 0.765 0.353 CB 1.476 18 residues pruned to eliminate duplicates Z: 13 16.341 2.180 0.821 0.364 1.000 0.667 CB 1.375 13 residues pruned to eliminate duplicates Z: 15 14.713 1.862 0.849 0.570 0.786 0.643 CA 1.358 15 residues pruned to eliminate duplicates Z: 65 55.634 2.246 1.136 0.554 0.922 0.516 CB 1.491 65 residues pruned to eliminate duplicates Z: 9 5.921 1.635 0.931 0.413 0.625 0.500 CA 1.162 Z: 9 3.784 1.605 0.096 0.349 1.000 0.625 CB 0.896 Z: 18 27.108 1.941 0.913 0.806 1.000 0.588 CA 1.356 18 residues pruned to eliminate duplicates Z: 14 17.773 1.995 0.622 0.914 0.923 0.692 CB 1.167 14 residues pruned to eliminate duplicates Z: 39 37.887 2.222 0.901 0.562 0.895 0.579 CB 1.531 150 residues pruned to eliminate duplicates 7 1.950 1.434 -0.192 0.516 1.000 0.667 CB 0.676 ? Z: 7 2.740 1.801 0.346 0.235 0.833 0.667 CB 0.754 Z: 18 20.892 2.231 1.027 0.307 0.882 0.353 CB 1.573 18 residues pruned to eliminate duplicates Z: 11 5.805 1.527 0.412 0.436 0.800 0.400 CB 1.137 Z: 10 7.056 1.696 0.452 0.377 0.889 0.667 CA 1.225 10 residues pruned to eliminate duplicates Z: 6 13.923 1.710 1.008 0.875 1.000 1.000 N 1.319 Z: 31 23.861 2.086 0.614 0.552 0.867 0.633 CB 1.419 31 residues pruned to eliminate duplicates Z: 26 35.545 2.117 1.083 0.641 0.960 0.680 CB 1.472 26 residues pruned to eliminate duplicates Z: 11 10.086 1.908 0.371 0.470 0.800 0.700 CB 1.571 20 residues pruned to eliminate duplicates 652 residues left after pruning, divided into chains as follows: A: 16 B: 27 C: 19 D: 6 E: 15 F: 17 G: 18 H: 8 I: 15 J: 6 K: 36 L: 98 M: 183 N: 7 O: 181 CC for partial structure against native data = 37.69 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 0.481, Connect. = 0.752 for dens.mod. cycle 1 = 0.300, Contrast = 0.561, Connect. = 0.780 for dens.mod. cycle 2 = 0.300, Contrast = 0.674, Connect. = 0.807 for dens.mod. cycle 3 = 0.300, Contrast = 0.690, Connect. = 0.811 for dens.mod. cycle 4 = 0.300, Contrast = 0.706, Connect. = 0.813 for dens.mod. cycle 5 = 0.300, Contrast = 0.714, Connect. = 0.815 for dens.mod. cycle 6 = 0.300, Contrast = 0.722, Connect. = 0.817 for dens.mod. cycle 7 = 0.300, Contrast = 0.725, Connect. = 0.818 for dens.mod. cycle 8 = 0.300, Contrast = 0.729, Connect. = 0.818 for dens.mod. cycle 9 = 0.300, Contrast = 0.731, Connect. = 0.819 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4242 peaks > 0.5 sigma used to seed fragment search Space for about 1045 unique residues taking solvent into account 1018 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 15 27.818 2.322 0.514 0.839 1.000 0.857 CA 1.579 B: 133 60.514 2.229 0.730 0.512 0.902 0.553 CB 1.497 C: 17 28.880 2.195 0.804 0.753 0.875 0.688 CB 1.664 17 residues pruned to eliminate duplicates D: 16 53.149 2.404 1.169 0.927 1.000 0.800 CB 1.845 E: 15 45.101 2.392 1.222 0.880 0.929 0.857 CB 1.770 15 residues pruned to eliminate duplicates F: 10 34.170 2.675 0.941 0.833 0.889 0.556 CB 1.851 11 residues pruned to eliminate duplicates G: 12 34.834 2.549 0.724 0.892 0.909 0.636 CA 1.888 12 residues pruned to eliminate duplicates H: 39 32.067 2.174 0.813 0.629 0.842 0.658 CB 1.388 I: 15 31.598 2.314 0.721 0.920 1.000 0.857 CB 1.494 J: 16 34.519 2.316 0.932 0.828 0.933 0.867 CA 1.607 K: 17 31.612 2.253 0.962 0.813 0.938 0.812 CB 1.453 17 residues pruned to eliminate duplicates L: 38 51.465 2.355 0.731 0.867 0.919 0.811 CB 1.652 M: 21 51.227 2.442 0.819 0.886 1.000 0.700 CB 1.861 21 residues pruned to eliminate duplicates N: 12 31.414 2.438 0.746 0.804 1.000 0.727 CB 1.706 12 residues pruned to eliminate duplicates O: 20 51.684 2.418 0.951 0.925 1.000 0.789 CA 1.764 20 residues pruned to eliminate duplicates P: 21 35.612 2.294 0.703 0.899 0.950 0.850 CB 1.533 Q: 16 47.403 2.380 1.121 0.929 0.933 0.800 CB 1.818 16 residues pruned to eliminate duplicates R: 10 32.083 2.620 0.883 0.857 0.889 0.444 CB 1.796 10 residues pruned to eliminate duplicates S: 15 43.600 2.421 1.121 0.869 0.929 0.786 CB 1.785 16 residues pruned to eliminate duplicates T: 30 36.317 2.297 0.823 0.449 0.966 0.552 CB 1.759 U: 14 25.293 2.189 0.629 0.837 0.923 0.615 CA 1.593 14 residues pruned to eliminate duplicates V: 53 35.153 2.144 0.796 0.573 0.885 0.577 CB 1.335 39 residues pruned to eliminate duplicates W: 22 43.899 2.302 0.856 0.862 0.905 0.810 CA 1.819 22 residues pruned to eliminate duplicates X: 15 26.812 2.312 0.609 0.864 0.929 0.786 CB 1.520 15 residues pruned to eliminate duplicates Y: 9 30.357 2.632 0.510 0.892 1.000 0.750 CB 1.939 9 residues pruned to eliminate duplicates Z: 35 26.882 2.213 0.784 0.453 0.824 0.529 CB 1.488 35 residues pruned to eliminate duplicates Z: 15 34.344 2.331 0.781 0.936 1.000 0.929 CB 1.540 15 residues pruned to eliminate duplicates Z: 16 35.918 2.279 0.987 0.806 0.933 0.800 CB 1.681 16 residues pruned to eliminate duplicates Z: 23 36.667 2.419 0.871 0.585 0.955 0.682 CB 1.668 8 residues pruned to eliminate duplicates Z: 15 17.311 2.043 0.609 0.423 1.000 0.857 CA 1.525 Z: 18 24.048 2.064 0.599 0.722 0.882 0.471 CA 1.639 18 residues pruned to eliminate duplicates Z: 14 25.669 2.229 0.676 0.823 0.923 0.615 CA 1.561 14 residues pruned to eliminate duplicates Z: 35 31.031 2.140 0.494 0.825 0.941 0.735 CB 1.335 21 residues pruned to eliminate duplicates Z: 20 40.396 2.293 0.866 0.925 1.000 0.789 CB 1.520 35 residues pruned to eliminate duplicates Z: 15 36.062 2.339 0.833 0.943 1.000 1.000 CB 1.557 15 residues pruned to eliminate duplicates Z: 38 45.817 2.321 0.827 0.619 0.973 0.595 CB 1.631 38 residues pruned to eliminate duplicates Z: 86 51.319 2.248 0.701 0.570 0.882 0.600 CB 1.543 86 residues pruned to eliminate duplicates Z: 20 35.653 2.436 0.425 0.906 0.947 0.737 CA 1.769 20 residues pruned to eliminate duplicates Z: 12 27.482 2.468 0.501 0.872 0.909 0.455 CB 1.793 12 residues pruned to eliminate duplicates Z: 30 46.898 2.343 0.979 0.585 1.000 0.724 CB 1.732 19 residues pruned to eliminate duplicates Z: 16 19.245 2.267 0.912 0.455 0.800 0.600 CA 1.501 Z: 16 49.197 2.420 1.200 0.913 0.933 0.800 CB 1.809 16 residues pruned to eliminate duplicates Z: 16 27.186 2.158 1.263 0.545 0.867 0.667 CB 1.588 Z: 16 33.832 2.250 0.958 0.787 0.933 0.667 CA 1.650 16 residues pruned to eliminate duplicates Z: 12 7.519 1.841 0.606 0.234 0.818 0.455 CB 1.276 Z: 16 51.609 2.391 1.368 0.908 0.933 0.867 CB 1.790 16 residues pruned to eliminate duplicates Z: 13 27.346 2.411 0.612 0.826 1.000 0.750 CB 1.531 13 residues pruned to eliminate duplicates Z: 16 32.786 2.265 0.881 0.825 0.933 0.667 CB 1.607 16 residues pruned to eliminate duplicates Z: 15 42.653 2.498 0.937 0.939 0.929 0.857 CB 1.762 15 residues pruned to eliminate duplicates Z: 14 17.768 2.160 0.667 0.392 1.000 0.769 CB 1.534 15 residues pruned to eliminate duplicates Z: 25 44.638 2.305 0.937 0.866 0.917 0.833 CB 1.630 25 residues pruned to eliminate duplicates Z: 15 40.891 2.419 0.828 0.894 1.000 0.929 CA 1.773 15 residues pruned to eliminate duplicates Z: 15 27.427 2.227 0.974 0.695 0.857 0.643 CB 1.628 15 residues pruned to eliminate duplicates Z: 21 37.125 2.226 0.859 0.882 0.950 0.650 CB 1.528 21 residues pruned to eliminate duplicates Z: 16 45.807 2.391 1.140 0.901 0.933 0.867 CB 1.767 16 residues pruned to eliminate duplicates Z: 17 36.603 2.230 1.163 0.822 1.000 0.812 CB 1.435 15 residues pruned to eliminate duplicates Z: 9 9.942 1.850 0.930 0.484 0.750 0.500 CA 1.334 9 residues pruned to eliminate duplicates Z: 111 68.086 2.270 0.760 0.625 0.955 0.636 CB 1.513 80 residues pruned to eliminate duplicates Z: 20 40.708 2.210 1.052 0.918 0.947 0.684 CB 1.533 20 residues pruned to eliminate duplicates Z: 15 31.488 2.304 0.735 0.919 1.000 0.857 CB 1.484 15 residues pruned to eliminate duplicates Z: 17 52.327 2.378 1.351 0.830 0.938 0.750 CB 1.877 17 residues pruned to eliminate duplicates Z: 36 40.273 2.311 0.702 0.605 0.943 0.629 CB 1.661 15 residues pruned to eliminate duplicates Z: 55 48.966 2.221 0.885 0.634 0.926 0.519 CB 1.516 52 residues pruned to eliminate duplicates Z: 14 32.376 2.462 0.456 0.930 1.000 1.000 CB 1.752 14 residues pruned to eliminate duplicates Z: 16 49.582 2.391 1.105 0.916 1.000 0.933 CB 1.796 16 residues pruned to eliminate duplicates Z: 21 40.797 2.254 0.818 0.927 1.000 0.900 CB 1.560 20 residues pruned to eliminate duplicates Z: 21 45.417 2.309 0.912 0.920 0.950 0.750 CA 1.705 21 residues pruned to eliminate duplicates Z: 17 13.178 1.908 0.679 0.445 0.938 0.500 CB 1.161 17 residues pruned to eliminate duplicates Z: 10 10.109 2.011 0.616 0.424 0.667 0.556 CB 1.683 10 residues pruned to eliminate duplicates Z: 29 36.244 2.438 1.004 0.405 0.857 0.536 CB 1.807 12 residues pruned to eliminate duplicates Z: 31 30.292 2.318 0.800 0.383 0.900 0.400 CB 1.668 30 residues pruned to eliminate duplicates Z: 16 28.287 2.136 0.595 0.938 0.933 0.867 CB 1.597 Z: 14 46.541 2.545 1.165 0.905 1.000 0.692 CB 1.667 14 residues pruned to eliminate duplicates Z: 16 10.764 1.922 0.887 0.310 0.800 0.467 CB 1.182 12 residues pruned to eliminate duplicates Z: 10 25.306 2.505 0.579 0.852 0.889 0.556 CB 1.775 10 residues pruned to eliminate duplicates Z: 12 22.045 2.249 0.766 0.801 0.818 0.636 CA 1.572 12 residues pruned to eliminate duplicates Z: 19 29.690 2.364 0.816 0.485 1.000 0.556 CB 1.655 19 residues pruned to eliminate duplicates Z: 28 37.898 2.249 0.933 0.567 0.963 0.630 CB 1.633 28 residues pruned to eliminate duplicates Z: 56 45.384 2.320 0.684 0.619 0.927 0.673 CB 1.509 56 residues pruned to eliminate duplicates Z: 31 35.988 2.336 0.748 0.517 0.933 0.700 CB 1.696 33 residues pruned to eliminate duplicates Z: 36 35.244 2.151 0.620 0.851 0.914 0.743 CB 1.384 21 residues pruned to eliminate duplicates Z: 17 30.564 2.057 0.663 0.935 1.000 0.625 CB 1.556 16 residues pruned to eliminate duplicates Z: 33 37.268 2.336 0.772 0.539 0.938 0.688 CB 1.633 33 residues pruned to eliminate duplicates Z: 23 38.148 2.302 0.748 0.868 0.955 0.773 CB 1.547 23 residues pruned to eliminate duplicates Z: 13 50.813 2.552 1.179 0.937 1.000 0.917 CB 1.835 13 residues pruned to eliminate duplicates Z: 38 51.857 2.351 0.747 0.865 0.919 0.622 CB 1.655 38 residues pruned to eliminate duplicates Z: 32 28.332 2.297 0.625 0.480 0.839 0.548 CB 1.658 32 residues pruned to eliminate duplicates Z: 16 25.742 2.248 0.779 0.776 0.800 0.533 CA 1.628 16 residues pruned to eliminate duplicates Z: 29 33.986 2.405 0.930 0.401 0.857 0.500 CB 1.792 29 residues pruned to eliminate duplicates Z: 9 17.672 2.062 0.845 0.648 0.875 0.625 CA 1.634 9 residues pruned to eliminate duplicates Z: 39 35.917 2.103 0.792 0.618 0.895 0.658 CB 1.546 39 residues pruned to eliminate duplicates Z: 12 46.235 2.558 1.248 0.931 0.909 0.909 CB 1.864 12 residues pruned to eliminate duplicates Z: 16 24.696 2.265 0.582 0.830 0.867 0.667 CA 1.544 16 residues pruned to eliminate duplicates Z: 15 8.381 1.824 0.844 0.346 0.786 0.500 CB 1.002 15 residues pruned to eliminate duplicates Z: 10 9.027 1.852 0.859 0.386 0.778 0.667 CB 1.268 10 residues pruned to eliminate duplicates Z: 17 24.705 2.055 0.357 0.903 1.000 0.875 CB 1.579 17 residues pruned to eliminate duplicates Z: 16 27.342 2.146 0.550 0.949 0.933 0.867 CB 1.570 16 residues pruned to eliminate duplicates Z: 15 23.612 2.214 0.403 0.904 1.000 0.786 CB 1.447 15 residues pruned to eliminate duplicates Z: 6 6.861 1.694 0.250 0.723 1.000 0.600 CA 1.185 6 residues pruned to eliminate duplicates Z: 20 52.317 2.417 1.073 0.905 0.947 0.842 CA 1.799 20 residues pruned to eliminate duplicates Z: 24 41.379 2.418 0.714 0.833 0.870 0.652 CB 1.796 24 residues pruned to eliminate duplicates Z: 20 47.300 2.465 0.782 0.915 0.947 0.842 CA 1.843 20 residues pruned to eliminate duplicates Z: 6 4.172 1.570 0.150 0.752 0.800 0.600 CB 1.031 6 residues pruned to eliminate duplicates Z: 17 42.950 2.384 1.029 0.814 1.000 0.750 CB 1.689 17 residues pruned to eliminate duplicates Z: 15 50.218 2.453 1.124 0.938 1.000 0.929 CB 1.791 15 residues pruned to eliminate duplicates Z: 36 36.811 2.280 0.678 0.604 0.914 0.657 CB 1.612 36 residues pruned to eliminate duplicates Z: 7 6.700 1.708 0.265 0.793 0.833 0.500 CA 1.175 7 residues pruned to eliminate duplicates Z: 16 29.866 2.229 0.648 0.774 1.000 0.667 CB 1.648 16 residues pruned to eliminate duplicates Z: 6 6.167 1.719 0.888 0.467 0.800 0.800 C 1.098 6 residues pruned to eliminate duplicates Z: 14 33.216 2.354 0.750 0.845 1.000 0.923 CA 1.664 14 residues pruned to eliminate duplicates Z: 27 24.731 2.295 0.842 0.378 0.769 0.500 CB 1.699 27 residues pruned to eliminate duplicates Z: 42 29.977 2.088 0.772 0.580 0.878 0.659 CB 1.335 42 residues pruned to eliminate duplicates Z: 19 21.395 2.100 0.758 0.436 0.944 0.556 CB 1.545 Z: 35 35.862 2.271 0.991 0.521 0.912 0.559 CB 1.461 35 residues pruned to eliminate duplicates Z: 18 28.690 1.964 0.995 0.928 0.882 0.588 CB 1.409 18 residues pruned to eliminate duplicates Z: 11 18.441 2.114 0.488 0.865 0.800 0.700 CB 1.697 11 residues pruned to eliminate duplicates Z: 15 26.340 2.093 0.570 0.939 1.000 0.857 CB 1.489 15 residues pruned to eliminate duplicates Z: 15 34.637 2.356 0.912 0.767 0.929 0.500 CB 1.747 15 residues pruned to eliminate duplicates Z: 16 35.517 2.276 1.264 0.836 0.933 0.733 CB 1.428 16 residues pruned to eliminate duplicates Z: 94 52.703 2.186 0.815 0.575 0.914 0.602 CB 1.402 94 residues pruned to eliminate duplicates Z: 52 42.630 2.289 0.707 0.571 0.902 0.588 CB 1.582 51 residues pruned to eliminate duplicates Z: 41 30.986 2.106 0.794 0.580 0.875 0.700 CB 1.372 41 residues pruned to eliminate duplicates Z: 16 27.945 2.230 0.801 0.692 0.867 0.467 CB 1.739 16 residues pruned to eliminate duplicates Z: 59 46.458 2.219 0.727 0.626 0.897 0.724 CB 1.578 59 residues pruned to eliminate duplicates Z: 17 45.394 2.435 1.185 0.821 0.938 0.750 CB 1.723 17 residues pruned to eliminate duplicates Z: 17 25.955 2.039 0.460 0.924 1.000 0.688 CB 1.531 17 residues pruned to eliminate duplicates Z: 109 53.233 2.171 0.762 0.554 0.870 0.593 CB 1.460 109 residues pruned to eliminate duplicates Z: 10 28.907 2.366 0.739 0.911 1.000 0.778 CA 1.660 10 residues pruned to eliminate duplicates Z: 28 38.914 2.396 0.817 0.608 0.852 0.704 CB 1.824 28 residues pruned to eliminate duplicates Z: 21 51.659 2.404 0.886 0.915 1.000 0.800 CA 1.801 21 residues pruned to eliminate duplicates Z: 15 48.269 2.412 1.158 0.881 1.000 0.857 CB 1.795 15 residues pruned to eliminate duplicates Z: 56 36.212 2.058 0.857 0.538 0.873 0.582 CB 1.410 56 residues pruned to eliminate duplicates Z: 14 24.396 2.154 0.923 0.804 0.846 0.769 CB 1.481 14 residues pruned to eliminate duplicates Z: 14 29.059 2.314 0.730 0.823 0.923 0.846 CA 1.648 14 residues pruned to eliminate duplicates Z: 17 30.712 2.045 0.798 0.922 1.000 0.438 CB 1.468 17 residues pruned to eliminate duplicates Z: 17 19.989 2.010 0.237 0.938 1.000 0.938 CB 1.398 17 residues pruned to eliminate duplicates Z: 18 25.799 1.980 0.412 0.948 1.000 0.941 CB 1.546 17 residues pruned to eliminate duplicates Z: 17 35.744 2.129 0.960 0.951 1.000 0.562 CB 1.477 17 residues pruned to eliminate duplicates Z: 36 37.562 2.165 0.619 0.846 0.971 0.686 CB 1.385 35 residues pruned to eliminate duplicates Z: 12 20.840 2.337 0.503 0.863 0.818 0.727 CA 1.604 12 residues pruned to eliminate duplicates Z: 19 19.973 2.117 0.806 0.428 0.889 0.778 CB 1.493 19 residues pruned to eliminate duplicates Z: 15 24.124 2.065 0.523 0.927 1.000 0.929 CB 1.437 15 residues pruned to eliminate duplicates Z: 8 9.911 2.213 0.369 0.656 0.714 0.286 CB 1.497 8 residues pruned to eliminate duplicates Z: 30 46.043 2.328 0.948 0.592 0.966 0.724 CA 1.788 30 residues pruned to eliminate duplicates Z: 15 43.049 2.362 1.112 0.826 1.000 0.643 CB 1.738 15 residues pruned to eliminate duplicates Z: 13 20.411 2.054 1.059 0.490 0.917 0.583 CB 1.535 13 residues pruned to eliminate duplicates Z: 26 34.318 2.436 0.841 0.468 0.920 0.440 CB 1.719 26 residues pruned to eliminate duplicates Z: 13 18.174 2.003 0.529 0.839 0.917 0.750 CB 1.395 Z: 30 43.878 2.475 0.893 0.575 0.931 0.690 CB 1.737 33 residues pruned to eliminate duplicates Z: 34 31.562 2.233 0.734 0.474 0.939 0.576 CB 1.551 34 residues pruned to eliminate duplicates Z: 38 48.030 2.358 0.549 0.869 0.946 0.730 CB 1.670 38 residues pruned to eliminate duplicates Z: 29 41.002 2.371 0.750 0.570 1.000 0.679 CB 1.746 29 residues pruned to eliminate duplicates Z: 14 13.995 1.973 0.646 0.429 0.923 0.615 CB 1.394 14 residues pruned to eliminate duplicates Z: 18 25.706 1.979 0.427 0.928 1.000 0.882 CB 1.546 18 residues pruned to eliminate duplicates Z: 18 16.806 1.880 0.784 0.469 0.941 0.588 CB 1.333 Z: 9 19.515 2.139 0.785 0.905 1.000 0.500 CB 1.286 9 residues pruned to eliminate duplicates Z: 15 10.626 1.994 0.681 0.191 0.786 0.286 CB 1.560 15 residues pruned to eliminate duplicates Z: 27 17.224 1.818 0.606 0.535 0.846 0.615 CB 1.322 27 residues pruned to eliminate duplicates Z: 15 18.600 2.141 0.669 0.447 0.929 0.643 CB 1.581 15 residues pruned to eliminate duplicates Z: 17 20.580 1.961 0.322 0.894 1.000 0.812 CB 1.424 17 residues pruned to eliminate duplicates Z: 15 25.984 2.109 0.536 0.933 1.000 0.786 CB 1.496 15 residues pruned to eliminate duplicates Z: 11 9.932 2.011 0.323 0.333 1.000 0.700 CB 1.418 Z: 17 24.564 2.007 0.497 0.872 1.000 0.875 CB 1.490 17 residues pruned to eliminate duplicates Z: 13 46.370 2.502 1.085 0.926 1.000 1.000 CB 1.799 13 residues pruned to eliminate duplicates Z: 39 51.726 2.287 0.727 0.856 0.974 0.737 CB 1.609 39 residues pruned to eliminate duplicates Z: 17 24.843 2.040 0.408 0.918 1.000 0.938 CB 1.524 17 residues pruned to eliminate duplicates Z: 13 12.017 1.924 0.229 0.862 1.000 0.750 CB 1.078 13 residues pruned to eliminate duplicates Z: 28 17.518 2.119 0.754 0.453 0.741 0.519 CB 1.285 28 residues pruned to eliminate duplicates Z: 18 26.261 1.985 0.507 0.922 1.000 0.941 CB 1.498 18 residues pruned to eliminate duplicates Z: 13 15.153 2.033 0.676 0.915 1.000 0.917 CB 0.908 13 residues pruned to eliminate duplicates Z: 16 27.831 2.223 0.848 0.571 0.933 0.533 CB 1.750 17 residues pruned to eliminate duplicates Z: 26 31.542 2.323 0.639 0.639 0.960 0.640 CB 1.515 26 residues pruned to eliminate duplicates Z: 40 27.636 2.129 0.592 0.616 0.897 0.667 CB 1.304 40 residues pruned to eliminate duplicates Z: 19 28.968 2.417 0.720 0.641 0.833 0.611 CB 1.727 19 residues pruned to eliminate duplicates Z: 29 36.839 2.494 0.721 0.465 0.964 0.714 CB 1.744 29 residues pruned to eliminate duplicates Z: 25 22.030 1.850 1.020 0.526 0.917 0.708 CB 1.280 Z: 35 36.146 2.156 0.692 0.847 0.941 0.706 CB 1.340 36 residues pruned to eliminate duplicates Z: 36 42.417 2.322 0.767 0.604 0.943 0.714 CB 1.680 36 residues pruned to eliminate duplicates Z: 22 41.461 2.389 0.796 0.853 0.952 0.714 CB 1.636 22 residues pruned to eliminate duplicates Z: 12 16.744 2.349 0.858 0.416 0.727 0.364 CB 1.737 12 residues pruned to eliminate duplicates Z: 16 34.172 2.266 0.852 0.833 1.000 0.667 CA 1.578 16 residues pruned to eliminate duplicates Z: 11 14.113 1.881 0.384 0.769 1.000 0.700 CB 1.351 9 residues pruned to eliminate duplicates Z: 15 16.617 1.927 0.738 0.455 1.000 0.714 CB 1.389 Z: 16 40.800 2.380 1.025 0.889 0.933 0.600 CB 1.685 16 residues pruned to eliminate duplicates Z: 16 23.604 2.127 0.473 0.907 0.933 0.800 CB 1.481 16 residues pruned to eliminate duplicates Z: 13 17.320 1.942 0.660 0.877 0.833 0.750 CA 1.352 13 residues pruned to eliminate duplicates Z: 7 5.449 1.789 0.721 0.249 0.667 0.333 O 1.449 7 residues pruned to eliminate duplicates Z: 15 25.933 2.207 0.502 0.930 1.000 0.571 CB 1.463 15 residues pruned to eliminate duplicates Z: 28 28.936 2.315 0.716 0.416 0.889 0.481 CB 1.721 29 residues pruned to eliminate duplicates Z: 17 25.965 2.051 0.442 0.930 1.000 0.938 CB 1.535 17 residues pruned to eliminate duplicates Z: 17 31.193 2.029 0.765 0.941 1.000 0.875 CB 1.510 17 residues pruned to eliminate duplicates Z: 86 56.327 2.236 0.860 0.584 0.906 0.624 CB 1.496 86 residues pruned to eliminate duplicates Z: 14 10.825 1.870 0.105 0.915 1.000 0.769 CB 1.026 14 residues pruned to eliminate duplicates Z: 14 21.577 2.267 0.549 0.724 1.000 0.692 CA 1.392 14 residues pruned to eliminate duplicates Z: 8 12.018 2.233 0.628 0.590 0.857 0.714 CB 1.338 8 residues pruned to eliminate duplicates Z: 41 27.062 2.100 0.656 0.563 0.825 0.650 CB 1.403 41 residues pruned to eliminate duplicates Z: 21 38.589 2.214 0.860 0.922 1.000 0.800 CB 1.473 21 residues pruned to eliminate duplicates Z: 12 10.875 2.060 0.584 0.316 0.818 0.545 CA 1.506 12 residues pruned to eliminate duplicates Z: 54 28.615 2.103 0.798 0.454 0.887 0.509 CB 1.229 25 residues pruned to eliminate duplicates Z: 15 39.941 2.425 1.057 0.926 0.929 0.714 CB 1.616 15 residues pruned to eliminate duplicates Z: 15 20.612 1.988 0.694 0.902 0.929 0.500 CB 1.256 15 residues pruned to eliminate duplicates Z: 84 60.270 2.311 0.758 0.633 0.952 0.651 CB 1.510 84 residues pruned to eliminate duplicates Z: 15 23.861 2.061 0.509 0.916 1.000 1.000 CB 1.448 15 residues pruned to eliminate duplicates Z: 12 8.530 1.887 0.722 0.247 0.727 0.545 CB 1.458 12 residues pruned to eliminate duplicates Z: 16 40.352 2.322 1.153 0.911 0.933 0.800 CB 1.582 16 residues pruned to eliminate duplicates Z: 15 30.272 2.071 0.813 0.934 1.000 0.857 CB 1.502 15 residues pruned to eliminate duplicates Z: 10 21.659 2.078 0.740 0.877 1.000 1.000 CB 1.450 10 residues pruned to eliminate duplicates Z: 17 25.466 2.024 0.550 0.914 1.000 0.312 CB 1.436 17 residues pruned to eliminate duplicates Z: 28 16.540 1.795 0.778 0.496 0.852 0.667 CB 1.175 28 residues pruned to eliminate duplicates Z: 39 33.402 2.084 0.768 0.616 0.921 0.658 CB 1.430 36 residues pruned to eliminate duplicates Z: 13 22.141 2.002 0.758 0.879 0.917 0.750 CB 1.437 13 residues pruned to eliminate duplicates Z: 18 23.238 2.011 0.416 0.921 1.000 0.882 CB 1.392 18 residues pruned to eliminate duplicates Z: 26 33.951 2.349 0.692 0.627 0.960 0.680 CB 1.579 26 residues pruned to eliminate duplicates Z: 21 18.032 1.853 0.653 0.557 1.000 0.450 CB 1.246 18 residues pruned to eliminate duplicates Z: 71 40.730 2.059 0.917 0.561 0.914 0.600 CB 1.271 71 residues pruned to eliminate duplicates Z: 16 33.796 2.117 0.803 0.951 1.000 1.000 CB 1.576 16 residues pruned to eliminate duplicates Z: 28 31.671 2.051 1.007 0.768 0.926 0.593 CB 1.261 32 residues pruned to eliminate duplicates Z: 6 4.158 1.967 -0.462 0.697 1.000 0.800 CB 1.468 Z: 6 8.481 1.870 0.375 0.764 1.000 0.600 CA 1.167 6 residues pruned to eliminate duplicates Z: 16 20.842 2.080 0.227 0.927 1.000 0.867 CB 1.478 16 residues pruned to eliminate duplicates Z: 20 24.420 2.063 0.798 0.529 0.947 0.737 CB 1.550 21 residues pruned to eliminate duplicates Z: 34 33.651 2.262 0.762 0.624 0.879 0.697 CB 1.487 34 residues pruned to eliminate duplicates Z: 16 21.882 2.132 1.057 0.549 0.867 0.733 CB 1.418 16 residues pruned to eliminate duplicates Z: 8 7.483 1.879 0.092 0.641 1.000 0.714 CB 1.208 Z: 14 29.575 2.424 0.697 0.595 1.000 0.538 CB 1.821 14 residues pruned to eliminate duplicates Z: 10 5.984 1.996 0.412 0.340 0.667 0.556 CB 1.265 6 residues pruned to eliminate duplicates Z: 18 20.851 2.220 0.475 0.844 0.824 0.706 CB 1.396 18 residues pruned to eliminate duplicates Z: 18 32.957 2.054 0.835 0.935 1.000 0.647 CB 1.479 18 residues pruned to eliminate duplicates Z: 16 38.835 2.200 0.917 0.924 1.000 0.867 CA 1.669 16 residues pruned to eliminate duplicates Z: 37 37.037 2.115 0.855 0.644 0.917 0.722 CB 1.501 37 residues pruned to eliminate duplicates Z: 15 63.220 2.478 1.741 0.939 1.000 0.857 CB 1.729 15 residues pruned to eliminate duplicates Z: 35 35.088 2.182 0.602 0.856 0.912 0.735 CB 1.393 35 residues pruned to eliminate duplicates Z: 16 30.933 2.240 0.795 0.793 1.000 0.533 CB 1.537 16 residues pruned to eliminate duplicates Z: 17 32.106 1.994 0.868 0.934 1.000 0.562 CB 1.502 17 residues pruned to eliminate duplicates Z: 20 19.652 1.890 0.772 0.541 1.000 0.579 CB 1.293 Z: 14 24.268 2.029 0.690 0.839 0.923 0.692 CB 1.589 Z: 21 39.142 2.191 1.007 0.901 0.950 0.750 CB 1.496 21 residues pruned to eliminate duplicates Z: 29 45.896 2.355 0.923 0.614 0.964 0.750 CB 1.783 29 residues pruned to eliminate duplicates Z: 15 26.872 2.174 0.621 0.852 0.929 0.714 CA 1.623 15 residues pruned to eliminate duplicates Z: 8 11.511 1.882 1.126 0.545 1.000 0.571 CB 1.040 8 residues pruned to eliminate duplicates Z: 6 5.188 1.651 0.286 0.576 0.800 0.200 N 1.269 6 residues pruned to eliminate duplicates Z: 18 36.191 2.008 1.011 0.936 1.000 0.941 CB 1.514 18 residues pruned to eliminate duplicates Z: 103 53.090 2.167 0.634 0.649 0.931 0.725 CB 1.387 105 residues pruned to eliminate duplicates Z: 15 34.835 2.418 0.926 0.705 0.929 0.643 CB 1.787 15 residues pruned to eliminate duplicates Z: 18 34.551 2.023 1.180 0.936 0.941 0.941 CB 1.406 18 residues pruned to eliminate duplicates Z: 15 10.515 1.861 0.843 0.431 0.786 0.643 CB 1.121 15 residues pruned to eliminate duplicates Z: 16 20.471 1.905 0.662 0.800 0.933 0.667 CB 1.376 14 residues pruned to eliminate duplicates Z: 23 29.482 2.319 0.795 0.491 0.909 0.727 CB 1.676 23 residues pruned to eliminate duplicates Z: 23 41.203 2.342 0.834 0.914 0.864 0.773 CB 1.674 23 residues pruned to eliminate duplicates Z: 31 35.423 2.247 0.698 0.653 0.933 0.600 CB 1.575 20 residues pruned to eliminate duplicates Z: 8 13.016 1.860 0.537 0.881 1.000 0.714 CB 1.246 8 residues pruned to eliminate duplicates Z: 27 37.257 2.300 0.644 0.829 0.923 0.731 CB 1.575 27 residues pruned to eliminate duplicates Z: 32 34.136 2.232 0.822 0.642 0.871 0.613 CB 1.515 32 residues pruned to eliminate duplicates Z: 15 35.168 2.191 0.918 0.838 1.000 0.714 CA 1.672 15 residues pruned to eliminate duplicates Z: 11 21.055 2.035 0.769 0.891 1.000 0.900 CB 1.330 11 residues pruned to eliminate duplicates Z: 15 12.661 1.965 1.023 0.330 0.786 0.571 CB 1.305 Z: 13 55.613 2.501 1.447 0.949 1.000 0.667 CB 1.811 13 residues pruned to eliminate duplicates Z: 19 37.034 2.260 0.756 0.911 1.000 1.000 CB 1.558 19 residues pruned to eliminate duplicates Z: 19 24.447 2.017 0.473 0.890 0.944 0.889 CB 1.478 19 residues pruned to eliminate duplicates Z: 11 14.898 2.059 0.852 0.870 0.800 0.400 CB 1.127 11 residues pruned to eliminate duplicates Z: 14 47.853 2.431 1.296 0.882 1.000 0.769 CB 1.720 14 residues pruned to eliminate duplicates Z: 7 4.262 1.937 0.066 0.625 0.833 0.833 CB 0.899 7 residues pruned to eliminate duplicates Z: 77 47.534 2.195 0.827 0.564 0.895 0.658 CB 1.428 77 residues pruned to eliminate duplicates Z: 20 21.012 1.914 0.781 0.577 0.947 0.684 CB 1.385 20 residues pruned to eliminate duplicates Z: 6 3.575 1.651 -0.031 0.624 0.800 0.600 CB 1.111 Z: 27 17.824 1.870 0.853 0.481 0.846 0.615 CB 1.216 27 residues pruned to eliminate duplicates Z: 28 47.155 2.382 0.825 0.671 1.000 0.741 CB 1.783 28 residues pruned to eliminate duplicates Z: 13 18.730 2.226 0.475 0.839 0.833 0.750 CA 1.476 13 residues pruned to eliminate duplicates Z: 9 15.130 2.015 0.790 0.652 0.875 0.500 CB 1.471 9 residues pruned to eliminate duplicates Z: 7 8.174 1.899 0.863 0.516 0.667 0.500 CA 1.393 7 residues pruned to eliminate duplicates Z: 28 17.083 1.858 0.596 0.530 0.889 0.630 CB 1.210 28 residues pruned to eliminate duplicates Z: 15 30.708 2.106 0.805 0.943 1.000 0.714 CB 1.496 15 residues pruned to eliminate duplicates Z: 13 10.702 1.971 0.352 0.451 0.917 0.750 CB 1.330 13 residues pruned to eliminate duplicates Z: 15 35.311 2.347 0.944 0.865 1.000 0.714 CB 1.516 15 residues pruned to eliminate duplicates Z: 21 25.889 2.252 0.881 0.541 0.900 0.450 CB 1.459 37 residues pruned to eliminate duplicates Z: 15 26.061 2.184 0.567 0.929 1.000 0.643 CB 1.424 15 residues pruned to eliminate duplicates Z: 18 15.903 2.023 0.651 0.547 0.941 0.529 CB 1.172 18 residues pruned to eliminate duplicates Z: 7 4.882 1.595 0.494 0.579 0.833 0.667 CB 0.930 Z: 16 30.153 2.129 0.686 0.946 1.000 0.667 CB 1.500 16 residues pruned to eliminate duplicates Z: 8 23.282 2.283 0.515 0.905 1.000 1.000 CB 1.810 8 residues pruned to eliminate duplicates Z: 23 13.968 1.986 0.591 0.505 0.864 0.545 CB 1.086 23 residues pruned to eliminate duplicates Z: 50 33.478 2.029 0.722 0.556 0.918 0.633 CB 1.412 51 residues pruned to eliminate duplicates Z: 18 35.935 2.002 1.102 0.947 1.000 0.647 CB 1.431 18 residues pruned to eliminate duplicates Z: 20 39.005 2.304 0.757 0.917 1.000 0.842 CB 1.560 20 residues pruned to eliminate duplicates Z: 13 20.044 1.934 0.644 0.918 0.917 0.750 CA 1.401 13 residues pruned to eliminate duplicates Z: 14 25.791 2.100 0.727 0.842 0.923 0.692 CA 1.592 14 residues pruned to eliminate duplicates Z: 8 14.264 2.141 1.070 0.676 0.857 0.571 CB 1.207 8 residues pruned to eliminate duplicates Z: 23 38.714 2.414 0.839 0.563 0.955 0.636 CB 1.831 23 residues pruned to eliminate duplicates Z: 11 17.534 2.031 0.511 0.578 1.000 0.800 CA 1.676 11 residues pruned to eliminate duplicates Z: 15 11.957 1.825 0.119 0.899 1.000 0.786 CB 1.119 15 residues pruned to eliminate duplicates Z: 19 27.755 1.979 0.629 0.931 1.000 0.889 CB 1.419 19 residues pruned to eliminate duplicates Z: 17 26.635 2.026 0.569 0.907 1.000 0.875 CB 1.488 17 residues pruned to eliminate duplicates Z: 105 56.650 2.197 0.769 0.549 0.923 0.596 CB 1.476 105 residues pruned to eliminate duplicates Z: 15 19.507 2.104 0.651 0.573 0.929 0.714 CB 1.505 15 residues pruned to eliminate duplicates Z: 19 35.459 2.282 0.687 0.889 1.000 0.833 CB 1.563 19 residues pruned to eliminate duplicates Z: 15 26.070 1.928 0.828 0.850 1.000 0.857 CA 1.465 14 residues pruned to eliminate duplicates Z: 51 39.637 2.205 0.816 0.541 0.880 0.560 CB 1.529 51 residues pruned to eliminate duplicates Z: 14 13.096 1.857 0.626 0.488 1.000 0.462 CB 1.217 14 residues pruned to eliminate duplicates Z: 19 42.628 2.344 0.863 0.918 1.000 0.833 CB 1.624 19 residues pruned to eliminate duplicates Z: 17 30.534 2.046 0.720 0.918 1.000 0.875 CB 1.529 17 residues pruned to eliminate duplicates Z: 10 10.722 1.629 0.479 0.859 1.000 0.444 CA 1.091 10 residues pruned to eliminate duplicates Z: 17 27.706 2.059 0.520 0.952 1.000 1.000 CB 1.525 17 residues pruned to eliminate duplicates Z: 14 20.550 1.947 0.657 0.800 0.923 0.846 CB 1.473 14 residues pruned to eliminate duplicates Z: 83 57.163 2.312 0.644 0.618 0.927 0.585 CB 1.602 74 residues pruned to eliminate duplicates Z: 9 12.754 2.120 0.760 0.376 1.000 0.750 CA 1.379 9 residues pruned to eliminate duplicates Z: 16 15.216 2.158 0.610 0.477 0.933 0.600 CB 1.240 16 residues pruned to eliminate duplicates Z: 14 26.797 2.205 0.552 0.927 1.000 1.000 CB 1.522 14 residues pruned to eliminate duplicates Z: 18 25.756 2.015 0.579 0.920 0.941 0.882 CB 1.469 18 residues pruned to eliminate duplicates Z: 26 14.179 1.770 0.554 0.488 0.920 0.640 CB 1.134 26 residues pruned to eliminate duplicates Z: 20 13.496 1.973 0.766 0.483 0.842 0.474 CB 1.074 20 residues pruned to eliminate duplicates Z: 18 34.532 2.077 0.744 0.952 1.000 1.000 CB 1.593 18 residues pruned to eliminate duplicates Z: 14 6.865 1.896 0.524 0.344 0.769 0.308 CB 1.015 14 residues pruned to eliminate duplicates Z: 8 11.364 1.839 0.606 0.903 0.857 0.857 CB 1.210 8 residues pruned to eliminate duplicates Z: 21 37.939 2.184 0.883 0.916 1.000 0.800 CB 1.457 21 residues pruned to eliminate duplicates Z: 56 52.947 2.345 0.671 0.651 0.982 0.727 CB 1.612 56 residues pruned to eliminate duplicates Z: 22 19.707 2.067 0.798 0.389 0.857 0.619 CB 1.519 22 residues pruned to eliminate duplicates Z: 12 13.419 1.692 0.708 0.792 0.909 0.545 CB 1.192 12 residues pruned to eliminate duplicates Z: 17 31.843 2.052 0.772 0.946 1.000 0.938 CB 1.514 17 residues pruned to eliminate duplicates Z: 22 21.226 2.273 0.400 0.513 0.905 0.762 CB 1.588 22 residues pruned to eliminate duplicates Z: 11 22.271 2.054 0.990 0.843 1.000 0.600 CB 1.282 11 residues pruned to eliminate duplicates Z: 31 35.274 2.334 1.060 0.411 0.900 0.500 CB 1.634 31 residues pruned to eliminate duplicates Z: 12 15.884 2.014 0.406 0.920 1.000 0.818 CB 1.191 12 residues pruned to eliminate duplicates Z: 15 23.661 2.176 0.525 0.923 0.929 0.929 CB 1.442 15 residues pruned to eliminate duplicates Z: 21 25.700 2.120 0.775 0.635 1.000 0.650 CB 1.345 21 residues pruned to eliminate duplicates Z: 14 27.807 2.240 0.769 0.822 1.000 0.846 CB 1.473 14 residues pruned to eliminate duplicates Z: 42 36.148 2.219 0.716 0.545 0.902 0.634 CB 1.573 42 residues pruned to eliminate duplicates Z: 25 17.128 1.866 0.585 0.491 0.958 0.542 CB 1.244 25 residues pruned to eliminate duplicates Z: 17 27.310 2.298 0.728 0.435 1.000 0.625 CA 1.839 17 residues pruned to eliminate duplicates Z: 14 19.227 1.907 0.619 0.777 0.923 0.692 CA 1.465 15 residues pruned to eliminate duplicates Z: 17 10.205 1.991 0.664 0.332 0.750 0.438 CB 1.233 17 residues pruned to eliminate duplicates Z: 15 20.763 1.936 0.829 0.748 0.929 0.500 CB 1.353 15 residues pruned to eliminate duplicates Z: 69 30.164 2.035 0.533 0.532 0.824 0.588 CB 1.380 69 residues pruned to eliminate duplicates Z: 18 11.408 1.818 0.690 0.413 0.882 0.529 CB 1.118 18 residues pruned to eliminate duplicates Z: 24 42.279 2.390 0.924 0.695 0.870 0.609 CB 1.845 24 residues pruned to eliminate duplicates Z: 37 36.024 2.321 0.982 0.442 0.861 0.611 CB 1.609 37 residues pruned to eliminate duplicates Z: 12 10.870 2.011 0.331 0.836 0.818 0.636 CB 1.121 12 residues pruned to eliminate duplicates Z: 18 25.696 1.982 0.438 0.935 1.000 0.941 CB 1.524 18 residues pruned to eliminate duplicates Z: 16 27.980 2.181 0.745 0.800 1.000 0.667 CB 1.459 16 residues pruned to eliminate duplicates Z: 13 14.355 1.990 0.281 0.828 0.833 0.667 CA 1.470 13 residues pruned to eliminate duplicates Z: 36 38.079 2.211 0.926 0.504 0.886 0.543 CB 1.701 36 residues pruned to eliminate duplicates Z: 8 14.099 2.357 0.578 0.392 1.000 0.571 CA 1.606 8 residues pruned to eliminate duplicates Z: 38 34.291 2.108 0.903 0.636 0.838 0.757 CB 1.476 38 residues pruned to eliminate duplicates Z: 95 52.766 2.168 0.805 0.568 0.894 0.585 CB 1.457 95 residues pruned to eliminate duplicates Z: 23 20.146 2.166 1.091 0.426 0.818 0.500 CB 1.252 23 residues pruned to eliminate duplicates Z: 18 31.783 2.018 0.831 0.927 1.000 0.824 CB 1.462 18 residues pruned to eliminate duplicates Z: 6 2.102 1.706 -0.062 0.664 1.000 0.800 CB 0.505 3 residues pruned to eliminate duplicates Z: 14 25.183 2.055 0.746 0.825 0.923 0.692 CA 1.591 14 residues pruned to eliminate duplicates Z: 20 18.339 2.066 0.736 0.504 0.947 0.579 CB 1.233 Z: 15 25.922 2.238 0.964 0.644 0.857 0.714 CA 1.607 15 residues pruned to eliminate duplicates Z: 33 37.648 2.376 0.989 0.476 0.875 0.438 CB 1.649 33 residues pruned to eliminate duplicates Z: 53 36.025 2.070 0.609 0.635 0.923 0.635 CB 1.432 43 residues pruned to eliminate duplicates Z: 20 16.638 2.236 0.783 0.377 0.789 0.579 CB 1.382 17 residues pruned to eliminate duplicates Z: 14 24.056 2.059 0.769 0.821 0.923 0.692 CA 1.502 14 residues pruned to eliminate duplicates Z: 22 32.127 2.402 0.765 0.525 0.857 0.476 CB 1.882 22 residues pruned to eliminate duplicates Z: 31 29.334 2.064 0.928 0.525 0.967 0.667 CB 1.358 32 residues pruned to eliminate duplicates Z: 23 13.937 1.812 0.688 0.513 0.773 0.545 CB 1.241 23 residues pruned to eliminate duplicates Z: 23 25.353 1.998 0.788 0.651 0.955 0.636 CB 1.377 23 residues pruned to eliminate duplicates Z: 21 11.635 1.884 0.568 0.352 0.800 0.500 CB 1.292 21 residues pruned to eliminate duplicates Z: 26 19.107 2.146 0.692 0.445 0.760 0.480 CB 1.466 26 residues pruned to eliminate duplicates Z: 26 18.558 1.768 0.800 0.507 0.960 0.720 CB 1.206 26 residues pruned to eliminate duplicates Z: 8 8.006 1.755 0.846 0.372 0.857 0.429 CB 1.249 8 residues pruned to eliminate duplicates Z: 31 34.551 2.312 0.984 0.470 0.867 0.667 CB 1.636 31 residues pruned to eliminate duplicates Z: 57 50.478 2.350 0.681 0.605 0.982 0.607 CB 1.574 57 residues pruned to eliminate duplicates Z: 13 23.177 2.249 0.774 0.479 1.000 0.833 CB 1.713 14 residues pruned to eliminate duplicates Z: 7 4.965 1.797 0.028 0.533 1.000 0.667 CB 1.062 Z: 20 16.511 2.072 0.364 0.517 0.842 0.632 CB 1.565 20 residues pruned to eliminate duplicates Z: 16 22.905 2.095 0.323 0.923 1.000 0.933 CB 1.500 16 residues pruned to eliminate duplicates Z: 21 36.159 2.292 0.814 0.892 0.950 0.850 CB 1.471 21 residues pruned to eliminate duplicates Z: 41 30.414 2.129 0.734 0.582 0.900 0.625 CB 1.339 41 residues pruned to eliminate duplicates Z: 25 30.730 2.243 0.811 0.442 0.958 0.667 CB 1.710 25 residues pruned to eliminate duplicates Z: 12 20.632 2.056 0.679 0.823 1.000 0.636 CB 1.362 12 residues pruned to eliminate duplicates Z: 13 16.814 1.919 0.975 0.597 0.917 0.583 CB 1.273 13 residues pruned to eliminate duplicates Z: 21 34.763 2.220 0.697 0.897 0.900 0.500 CB 1.641 21 residues pruned to eliminate duplicates Z: 6 3.765 1.568 0.228 0.440 0.800 0.600 CB 1.163 Z: 17 28.571 2.246 0.695 0.846 0.938 0.812 CB 1.486 17 residues pruned to eliminate duplicates Z: 41 47.070 2.320 0.629 0.785 0.975 0.700 CB 1.571 41 residues pruned to eliminate duplicates Z: 35 35.723 2.254 0.735 0.509 0.912 0.647 CB 1.702 35 residues pruned to eliminate duplicates Z: 6 2.313 1.228 0.060 0.673 0.800 0.600 O 0.846 Z: 11 15.028 1.999 0.363 0.821 1.000 0.700 CB 1.321 11 residues pruned to eliminate duplicates Z: 14 22.487 2.177 0.832 0.468 1.000 0.846 CB 1.616 14 residues pruned to eliminate duplicates Z: 17 22.093 2.145 0.773 0.477 0.938 0.812 CB 1.586 17 residues pruned to eliminate duplicates Z: 10 19.561 1.968 0.521 0.918 1.000 0.889 CB 1.537 10 residues pruned to eliminate duplicates Z: 16 19.815 1.903 0.616 0.794 0.933 0.667 CA 1.378 16 residues pruned to eliminate duplicates Z: 47 31.613 2.209 0.718 0.509 0.826 0.478 CB 1.474 47 residues pruned to eliminate duplicates Z: 78 46.409 2.157 0.633 0.641 0.909 0.675 CB 1.448 78 residues pruned to eliminate duplicates Z: 16 17.097 2.170 0.672 0.549 0.933 0.867 CB 1.243 17 residues pruned to eliminate duplicates Z: 16 13.966 1.838 0.508 0.545 1.000 0.667 CB 1.245 16 residues pruned to eliminate duplicates Z: 14 33.309 2.244 1.006 0.774 1.000 0.462 CB 1.611 14 residues pruned to eliminate duplicates Z: 24 18.725 1.885 0.652 0.516 0.913 0.609 CB 1.351 45 residues pruned to eliminate duplicates Z: 12 29.330 2.355 0.673 0.847 1.000 0.727 CB 1.666 12 residues pruned to eliminate duplicates Z: 14 21.190 1.849 0.977 0.821 0.846 0.615 CB 1.439 15 residues pruned to eliminate duplicates Z: 13 36.966 2.312 1.173 0.902 0.917 0.917 CB 1.652 13 residues pruned to eliminate duplicates Z: 35 31.892 2.140 0.551 0.824 0.971 0.706 CB 1.282 35 residues pruned to eliminate duplicates Z: 15 15.438 1.837 0.388 0.929 1.000 0.643 CB 1.132 Z: 7 8.254 1.810 0.393 0.884 1.000 0.667 CB 0.965 7 residues pruned to eliminate duplicates Z: 26 15.998 1.887 0.494 0.532 0.880 0.720 CB 1.250 26 residues pruned to eliminate duplicates Z: 108 68.346 2.284 0.688 0.655 0.944 0.692 CB 1.573 108 residues pruned to eliminate duplicates Z: 9 15.700 2.055 0.762 0.524 1.000 0.750 CB 1.497 9 residues pruned to eliminate duplicates Z: 12 18.288 2.077 0.444 0.830 1.000 0.636 CB 1.382 12 residues pruned to eliminate duplicates Z: 24 38.800 2.326 0.966 0.617 0.913 0.739 CB 1.735 24 residues pruned to eliminate duplicates Z: 7 16.321 2.013 1.001 0.661 1.000 0.667 CB 1.424 7 residues pruned to eliminate duplicates Z: 11 6.316 1.884 0.552 0.345 0.800 0.700 CB 1.011 11 residues pruned to eliminate duplicates Z: 34 36.025 2.336 0.749 0.524 0.909 0.576 CB 1.649 34 residues pruned to eliminate duplicates Z: 10 13.917 1.788 0.548 0.904 1.000 0.778 CB 1.194 9 residues pruned to eliminate duplicates Z: 26 20.420 2.121 0.639 0.376 0.920 0.560 CB 1.457 26 residues pruned to eliminate duplicates Z: 6 9.779 2.013 0.528 0.806 0.800 0.800 CA 1.360 6 residues pruned to eliminate duplicates Z: 11 8.403 1.702 1.021 0.375 0.800 0.300 CB 1.104 11 residues pruned to eliminate duplicates Z: 14 24.538 2.241 0.804 0.555 1.000 0.769 CB 1.595 14 residues pruned to eliminate duplicates Z: 13 39.232 2.480 0.728 0.931 1.000 1.000 CB 1.847 13 residues pruned to eliminate duplicates Z: 28 23.118 2.131 1.114 0.480 0.852 0.556 CB 1.183 28 residues pruned to eliminate duplicates Z: 12 22.756 2.026 1.021 0.919 0.818 0.636 CB 1.443 12 residues pruned to eliminate duplicates Z: 15 20.991 2.154 0.764 0.568 0.929 0.786 CB 1.489 15 residues pruned to eliminate duplicates Z: 11 16.690 2.147 0.743 0.896 0.900 0.700 CB 1.122 11 residues pruned to eliminate duplicates Z: 89 48.850 2.158 0.776 0.563 0.886 0.523 CB 1.443 89 residues pruned to eliminate duplicates Z: 17 22.544 2.038 0.275 0.918 1.000 0.812 CB 1.530 17 residues pruned to eliminate duplicates Z: 99 52.788 2.134 0.757 0.567 0.918 0.571 CB 1.451 99 residues pruned to eliminate duplicates Z: 16 31.120 2.101 0.744 0.934 1.000 0.733 CB 1.529 16 residues pruned to eliminate duplicates Z: 6 5.213 1.947 0.208 0.751 0.600 0.600 CB 1.320 6 residues pruned to eliminate duplicates Z: 25 31.351 2.295 0.827 0.690 0.833 0.750 CB 1.539 25 residues pruned to eliminate duplicates Z: 24 20.037 1.996 0.632 0.426 0.913 0.565 CA 1.517 24 residues pruned to eliminate duplicates Z: 6 2.262 1.542 0.059 0.409 0.800 0.400 N 0.852 4 residues pruned to eliminate duplicates Z: 20 49.710 2.403 1.094 0.894 0.895 0.684 CA 1.817 20 residues pruned to eliminate duplicates Z: 18 28.477 2.086 0.660 0.915 1.000 0.882 CB 1.409 18 residues pruned to eliminate duplicates Z: 15 16.952 2.245 0.805 0.441 0.714 0.429 CB 1.663 15 residues pruned to eliminate duplicates Z: 23 25.223 2.083 0.849 0.716 0.909 0.500 CB 1.263 23 residues pruned to eliminate duplicates Z: 7 5.420 1.804 -0.177 0.689 1.000 0.667 CB 1.253 Z: 16 19.120 2.063 0.092 0.927 1.000 0.933 CB 1.535 16 residues pruned to eliminate duplicates Z: 6 7.158 1.747 1.036 0.470 0.600 0.400 C 1.547 6 residues pruned to eliminate duplicates Z: 18 31.256 2.077 0.702 0.941 1.000 0.882 CB 1.488 18 residues pruned to eliminate duplicates Z: 45 35.620 2.084 0.935 0.575 0.932 0.659 CB 1.330 75 residues pruned to eliminate duplicates Z: 10 3.408 1.639 0.030 0.375 0.667 0.444 CB 1.154 10 residues pruned to eliminate duplicates Z: 10 17.051 2.079 0.616 0.624 1.000 0.333 CB 1.506 10 residues pruned to eliminate duplicates Z: 57 36.124 2.144 0.683 0.636 0.875 0.679 CB 1.346 57 residues pruned to eliminate duplicates Z: 39 28.645 2.223 0.747 0.430 0.816 0.474 CB 1.577 39 residues pruned to eliminate duplicates Z: 29 43.161 2.323 0.854 0.648 0.929 0.571 CB 1.776 29 residues pruned to eliminate duplicates Z: 15 17.259 1.830 0.470 0.913 1.000 1.000 CB 1.213 15 residues pruned to eliminate duplicates Z: 43 31.260 2.042 0.713 0.553 0.905 0.548 CB 1.447 43 residues pruned to eliminate duplicates Z: 50 47.180 2.308 0.634 0.678 0.939 0.612 CB 1.615 50 residues pruned to eliminate duplicates Z: 13 22.403 2.261 0.471 0.836 0.917 0.833 CA 1.589 13 residues pruned to eliminate duplicates Z: 12 15.670 1.994 0.475 0.891 0.909 0.818 CB 1.270 12 residues pruned to eliminate duplicates Z: 8 8.837 1.830 0.451 0.877 0.714 0.571 CB 1.280 8 residues pruned to eliminate duplicates Z: 17 26.680 2.071 0.461 0.944 1.000 0.812 CB 1.527 17 residues pruned to eliminate duplicates Z: 8 9.338 1.839 1.153 0.536 0.857 0.571 CA 1.004 8 residues pruned to eliminate duplicates Z: 21 47.356 2.312 0.875 0.902 1.000 0.850 CB 1.742 21 residues pruned to eliminate duplicates Z: 105 72.242 2.302 0.766 0.676 0.942 0.712 CB 1.572 105 residues pruned to eliminate duplicates Z: 18 30.339 2.027 0.809 0.921 1.000 0.882 CB 1.412 18 residues pruned to eliminate duplicates Z: 26 28.048 2.259 0.642 0.518 0.840 0.640 CB 1.769 26 residues pruned to eliminate duplicates Z: 59 39.873 2.174 0.675 0.629 0.897 0.690 CB 1.421 59 residues pruned to eliminate duplicates Z: 14 19.709 2.002 0.575 0.847 0.923 0.846 CA 1.394 Z: 42 29.962 2.025 0.746 0.630 0.927 0.732 CB 1.264 42 residues pruned to eliminate duplicates 8 1.514 1.507 -0.195 0.243 0.857 0.571 CB 0.741 ? Z: 15 12.949 2.060 0.551 0.373 0.857 0.714 CB 1.447 15 residues pruned to eliminate duplicates Z: 14 13.581 2.033 0.366 0.459 0.846 0.692 CB 1.671 14 residues pruned to eliminate duplicates Z: 42 38.996 2.323 0.581 0.551 0.976 0.683 CB 1.617 65 residues pruned to eliminate duplicates Z: 21 30.517 2.374 0.804 0.460 0.950 0.450 CB 1.746 21 residues pruned to eliminate duplicates Z: 7 4.182 1.956 -0.382 0.647 1.000 0.667 CB 1.232 7 residues pruned to eliminate duplicates Z: 8 2.978 1.694 -0.168 0.683 1.000 0.571 CB 0.675 Z: 16 27.644 1.969 0.850 0.914 1.000 0.667 CB 1.386 16 residues pruned to eliminate duplicates Z: 13 11.416 1.770 0.711 0.589 0.833 0.833 CB 1.199 13 residues pruned to eliminate duplicates Z: 17 30.964 2.071 0.706 0.916 1.000 0.875 CB 1.547 17 residues pruned to eliminate duplicates Z: 18 11.081 1.976 0.672 0.426 0.765 0.529 CB 1.149 18 residues pruned to eliminate duplicates Z: 19 37.893 2.288 0.923 0.929 0.944 0.722 CB 1.505 19 residues pruned to eliminate duplicates Z: 20 44.183 2.385 0.857 0.883 1.000 0.789 CB 1.655 20 residues pruned to eliminate duplicates Z: 30 28.267 1.951 0.664 0.688 1.000 0.586 CB 1.361 31 residues pruned to eliminate duplicates Z: 15 34.905 2.202 0.901 0.865 1.000 0.786 CA 1.633 15 residues pruned to eliminate duplicates Z: 18 25.635 1.997 0.544 0.899 1.000 0.647 CB 1.441 18 residues pruned to eliminate duplicates Z: 9 16.620 2.250 0.884 0.776 0.750 0.500 CA 1.449 9 residues pruned to eliminate duplicates Z: 10 10.706 2.117 0.566 0.485 0.778 0.556 CA 1.405 10 residues pruned to eliminate duplicates Z: 15 35.216 2.190 0.875 0.861 1.000 0.571 CA 1.684 15 residues pruned to eliminate duplicates Z: 100 58.000 2.186 0.821 0.570 0.939 0.566 CB 1.456 100 residues pruned to eliminate duplicates Z: 31 33.195 2.172 0.796 0.553 0.933 0.600 CB 1.581 31 residues pruned to eliminate duplicates Z: 22 17.563 1.870 0.672 0.541 0.857 0.714 CB 1.374 22 residues pruned to eliminate duplicates Z: 23 14.370 1.908 0.476 0.526 0.864 0.727 CB 1.228 23 residues pruned to eliminate duplicates Z: 35 28.567 2.027 0.670 0.672 0.971 0.676 CB 1.272 35 residues pruned to eliminate duplicates Z: 45 37.274 2.142 0.773 0.596 0.909 0.614 CB 1.485 45 residues pruned to eliminate duplicates Z: 11 22.817 2.096 0.704 0.910 1.000 0.800 CB 1.433 11 residues pruned to eliminate duplicates Z: 25 28.232 2.291 0.720 0.505 0.875 0.667 CB 1.663 25 residues pruned to eliminate duplicates Z: 35 36.223 2.207 0.978 0.665 0.912 0.706 CB 1.339 35 residues pruned to eliminate duplicates Z: 30 37.083 2.285 0.727 0.593 0.931 0.552 CB 1.715 30 residues pruned to eliminate duplicates Z: 18 11.767 1.762 0.483 0.454 0.882 0.588 CB 1.298 18 residues pruned to eliminate duplicates Z: 17 30.788 2.032 0.917 0.895 1.000 0.625 CB 1.416 17 residues pruned to eliminate duplicates Z: 15 13.899 2.053 0.420 0.377 0.929 0.643 CB 1.564 15 residues pruned to eliminate duplicates Z: 9 16.358 2.067 0.496 0.868 1.000 0.875 CB 1.367 9 residues pruned to eliminate duplicates Z: 7 8.403 1.484 0.476 0.841 1.000 0.833 CB 1.167 6 residues pruned to eliminate duplicates Z: 15 11.819 1.705 0.744 0.631 0.929 0.643 CB 1.011 15 residues pruned to eliminate duplicates Z: 6 3.558 1.334 0.405 0.707 0.800 0.600 CB 0.879 6 residues pruned to eliminate duplicates Z: 17 13.771 1.996 0.336 0.528 0.938 0.625 CB 1.339 17 residues pruned to eliminate duplicates Z: 9 7.853 1.782 0.468 0.407 0.875 0.625 CA 1.337 9 residues pruned to eliminate duplicates Z: 44 34.563 2.231 0.786 0.483 0.907 0.581 CB 1.483 44 residues pruned to eliminate duplicates Z: 39 36.760 2.104 0.976 0.633 0.868 0.526 CB 1.457 39 residues pruned to eliminate duplicates Z: 17 34.019 2.124 0.939 0.844 1.000 0.688 CA 1.536 17 residues pruned to eliminate duplicates Z: 14 19.298 2.024 0.740 0.657 0.846 0.692 CB 1.553 14 residues pruned to eliminate duplicates Z: 21 34.392 2.167 0.735 0.874 1.000 0.700 CB 1.489 21 residues pruned to eliminate duplicates Z: 25 18.673 1.984 0.560 0.398 0.917 0.667 CB 1.496 25 residues pruned to eliminate duplicates Z: 35 32.348 2.171 0.437 0.856 0.941 0.765 CB 1.393 35 residues pruned to eliminate duplicates Z: 40 32.616 2.053 0.718 0.619 0.923 0.718 CB 1.434 40 residues pruned to eliminate duplicates Z: 20 25.827 2.033 0.852 0.532 1.000 0.895 CB 1.525 20 residues pruned to eliminate duplicates Z: 38 42.256 2.129 1.020 0.669 0.892 0.568 CB 1.548 38 residues pruned to eliminate duplicates Z: 17 24.542 2.045 0.360 0.912 1.000 0.875 CB 1.562 17 residues pruned to eliminate duplicates Z: 36 36.332 2.126 0.673 0.816 1.000 0.743 CB 1.311 36 residues pruned to eliminate duplicates Z: 6 9.223 1.745 0.990 0.753 1.000 1.000 CB 0.948 Z: 20 25.920 2.015 1.026 0.674 1.000 0.368 CB 1.240 20 residues pruned to eliminate duplicates Z: 14 6.649 1.846 0.110 0.557 0.923 0.538 CB 0.922 8 residues pruned to eliminate duplicates Z: 14 20.457 2.053 0.627 0.852 0.923 0.769 CA 1.361 14 residues pruned to eliminate duplicates Z: 8 4.797 1.778 -0.066 0.494 0.857 0.571 N 1.282 7 residues pruned to eliminate duplicates Z: 7 7.266 1.882 0.559 0.419 0.833 0.333 CA 1.321 7 residues pruned to eliminate duplicates Z: 17 23.733 1.976 0.632 0.918 1.000 0.875 CB 1.297 17 residues pruned to eliminate duplicates Z: 17 22.672 2.070 1.173 0.404 0.938 0.625 CB 1.487 Z: 18 29.952 2.023 0.662 0.935 1.000 0.824 CB 1.506 18 residues pruned to eliminate duplicates Z: 24 16.603 1.767 0.689 0.577 0.870 0.739 CB 1.238 24 residues pruned to eliminate duplicates Z: 20 19.436 1.944 0.949 0.545 0.842 0.632 CB 1.337 20 residues pruned to eliminate duplicates Z: 6 5.095 1.780 -0.194 0.883 1.000 1.000 CB 1.149 6 residues pruned to eliminate duplicates Z: 29 15.980 1.879 0.507 0.475 0.929 0.607 CB 1.179 29 residues pruned to eliminate duplicates Z: 30 36.370 2.214 0.866 0.560 0.931 0.793 CB 1.657 30 residues pruned to eliminate duplicates Z: 21 25.890 2.385 0.667 0.573 0.800 0.500 CB 1.696 21 residues pruned to eliminate duplicates Z: 32 45.484 2.411 0.923 0.565 0.968 0.710 CB 1.710 33 residues pruned to eliminate duplicates Z: 19 9.356 1.845 0.343 0.444 0.778 0.278 CB 1.212 19 residues pruned to eliminate duplicates Z: 14 18.175 2.038 0.405 0.838 0.923 0.846 CA 1.426 14 residues pruned to eliminate duplicates Z: 15 26.051 2.021 0.850 0.863 1.000 0.786 CB 1.366 14 residues pruned to eliminate duplicates Z: 30 24.455 1.991 0.823 0.527 0.897 0.621 CB 1.359 30 residues pruned to eliminate duplicates Z: 33 40.455 2.245 0.793 0.591 0.938 0.781 CB 1.736 33 residues pruned to eliminate duplicates Z: 7 4.455 1.679 0.418 0.455 0.667 0.500 CA 1.200 Z: 76 53.825 2.231 0.798 0.599 0.920 0.587 CB 1.532 76 residues pruned to eliminate duplicates Z: 10 13.631 2.031 0.358 0.510 1.000 0.556 CA 1.631 10 residues pruned to eliminate duplicates Z: 15 14.001 1.802 0.461 0.940 1.000 0.786 CB 0.987 15 residues pruned to eliminate duplicates Z: 15 29.923 2.304 0.535 0.920 1.000 1.000 CB 1.592 15 residues pruned to eliminate duplicates Z: 6 4.599 1.770 0.001 0.416 1.000 0.400 CB 1.267 Z: 19 29.716 1.962 0.686 0.934 1.000 0.833 CB 1.476 19 residues pruned to eliminate duplicates Z: 8 2.557 1.545 0.096 0.555 0.857 0.571 CB 0.631 Z: 33 16.860 1.808 0.647 0.440 0.844 0.562 CB 1.262 33 residues pruned to eliminate duplicates Z: 17 15.134 1.968 0.489 0.787 0.875 0.688 CB 1.147 17 residues pruned to eliminate duplicates Z: 50 45.819 2.260 0.696 0.660 0.918 0.592 CB 1.603 50 residues pruned to eliminate duplicates Z: 62 51.877 2.351 0.677 0.562 0.934 0.607 CB 1.698 62 residues pruned to eliminate duplicates Z: 14 11.108 1.743 0.600 0.547 0.846 0.692 CB 1.248 14 residues pruned to eliminate duplicates Z: 15 22.174 2.243 0.928 0.496 0.857 0.714 CB 1.606 15 residues pruned to eliminate duplicates Z: 13 13.638 2.093 0.530 0.386 0.833 0.583 CB 1.665 13 residues pruned to eliminate duplicates Z: 19 17.816 2.021 0.927 0.514 0.889 0.667 CB 1.196 18 residues pruned to eliminate duplicates Z: 36 27.531 1.951 0.956 0.585 0.800 0.429 CB 1.404 36 residues pruned to eliminate duplicates Z: 10 16.509 2.214 0.438 0.572 1.000 0.778 CA 1.613 Z: 18 11.049 2.009 0.175 0.523 0.824 0.647 CB 1.347 18 residues pruned to eliminate duplicates Z: 13 11.730 2.174 0.406 0.415 0.917 0.667 CB 1.321 13 residues pruned to eliminate duplicates Z: 35 27.057 2.073 0.672 0.530 0.971 0.559 CB 1.339 35 residues pruned to eliminate duplicates Z: 65 48.114 2.226 0.797 0.609 0.891 0.625 CB 1.522 65 residues pruned to eliminate duplicates Z: 13 11.190 1.828 0.456 0.635 0.917 0.500 CB 1.166 13 residues pruned to eliminate duplicates Z: 17 31.412 2.365 0.834 0.467 1.000 0.625 CA 1.871 17 residues pruned to eliminate duplicates Z: 17 25.180 2.052 0.389 0.936 1.000 0.938 CB 1.538 17 residues pruned to eliminate duplicates Z: 28 54.366 2.412 0.965 0.696 1.000 0.704 CB 1.846 28 residues pruned to eliminate duplicates Z: 26 18.571 2.061 0.538 0.478 0.800 0.400 CB 1.497 26 residues pruned to eliminate duplicates Z: 14 28.104 2.146 0.737 0.899 1.000 0.846 CB 1.495 14 residues pruned to eliminate duplicates Z: 6 6.082 1.775 0.406 0.626 0.800 0.600 CB 1.210 Z: 17 28.203 2.000 0.700 0.920 1.000 0.875 CB 1.460 17 residues pruned to eliminate duplicates Z: 13 50.067 2.448 1.491 0.936 1.000 0.750 CB 1.651 13 residues pruned to eliminate duplicates Z: 18 13.461 2.072 0.653 0.472 0.824 0.588 CB 1.191 18 residues pruned to eliminate duplicates Z: 7 7.756 1.574 0.687 0.693 1.000 0.667 CA 1.000 7 residues pruned to eliminate duplicates Z: 10 28.654 2.265 0.972 0.868 1.000 0.667 CA 1.564 10 residues pruned to eliminate duplicates Z: 26 28.033 2.384 0.651 0.556 0.800 0.560 CB 1.686 26 residues pruned to eliminate duplicates Z: 14 12.397 1.751 0.679 0.577 0.923 0.692 CB 1.177 14 residues pruned to eliminate duplicates Z: 14 23.165 2.175 0.581 0.912 0.923 0.769 CB 1.433 14 residues pruned to eliminate duplicates Z: 12 21.192 2.063 0.533 0.884 1.000 0.909 CB 1.460 12 residues pruned to eliminate duplicates Z: 49 45.213 2.240 0.830 0.587 0.958 0.562 CB 1.528 49 residues pruned to eliminate duplicates Z: 17 26.338 2.042 0.612 0.915 0.938 0.812 CB 1.508 17 residues pruned to eliminate duplicates Z: 11 20.266 2.135 0.995 0.897 0.900 0.800 CB 1.197 11 residues pruned to eliminate duplicates Z: 12 6.180 1.605 1.043 0.319 0.636 0.455 N 1.091 Z: 14 11.827 1.869 0.085 0.922 1.000 1.000 CB 1.137 14 residues pruned to eliminate duplicates Z: 25 14.766 1.801 0.672 0.432 0.833 0.625 CB 1.289 25 residues pruned to eliminate duplicates Z: 6 8.523 1.604 1.012 0.818 1.000 1.000 N 0.897 Z: 8 3.823 1.734 -0.019 0.429 0.857 0.286 CB 1.067 Z: 28 29.629 2.294 0.813 0.478 0.852 0.481 CB 1.646 28 residues pruned to eliminate duplicates Z: 6 8.688 2.133 0.590 0.667 0.800 0.800 CB 1.228 6 residues pruned to eliminate duplicates Z: 41 41.615 2.217 0.788 0.596 0.975 0.675 CB 1.554 41 residues pruned to eliminate duplicates Z: 35 32.669 2.246 0.649 0.564 0.882 0.618 CB 1.611 35 residues pruned to eliminate duplicates Z: 7 8.349 1.725 0.299 0.536 1.000 0.500 N 1.469 Z: 21 35.309 2.286 0.718 0.860 0.900 0.600 CA 1.642 21 residues pruned to eliminate duplicates Z: 7 7.743 1.779 0.681 0.484 0.833 0.667 CB 1.289 7 residues pruned to eliminate duplicates Z: 16 22.313 1.962 0.503 0.914 1.000 0.933 CB 1.381 16 residues pruned to eliminate duplicates Z: 26 17.644 1.779 0.771 0.554 0.880 0.680 CB 1.207 26 residues pruned to eliminate duplicates Z: 14 39.315 2.338 1.058 0.839 1.000 0.846 CA 1.692 14 residues pruned to eliminate duplicates Z: 9 10.234 1.988 0.271 0.799 1.000 0.750 CB 1.103 9 residues pruned to eliminate duplicates Z: 34 38.822 2.134 0.843 0.663 0.939 0.636 CB 1.573 34 residues pruned to eliminate duplicates Z: 20 12.998 1.862 0.558 0.325 0.789 0.474 CB 1.579 17 residues pruned to eliminate duplicates Z: 12 6.301 1.629 0.372 0.311 0.818 0.636 CB 1.282 12 residues pruned to eliminate duplicates Z: 14 18.806 2.213 0.585 0.471 1.000 0.769 CA 1.532 14 residues pruned to eliminate duplicates Z: 7 3.077 1.516 0.028 0.470 0.833 0.500 CA 0.997 Z: 14 11.904 1.847 0.133 0.924 1.000 0.846 CB 1.108 14 residues pruned to eliminate duplicates Z: 59 47.989 2.308 0.824 0.555 0.897 0.552 CB 1.582 59 residues pruned to eliminate duplicates Z: 13 20.860 1.935 0.889 0.920 0.833 0.750 CA 1.392 13 residues pruned to eliminate duplicates Z: 15 20.013 2.013 0.863 0.468 1.000 0.571 CB 1.473 15 residues pruned to eliminate duplicates Z: 7 4.726 1.647 0.075 0.608 0.833 0.667 CA 1.180 Z: 14 13.916 1.751 0.546 0.621 1.000 0.769 CB 1.272 14 residues pruned to eliminate duplicates Z: 14 27.649 2.140 0.705 0.727 1.000 0.769 CA 1.713 14 residues pruned to eliminate duplicates Z: 19 25.833 2.114 0.730 0.669 1.000 0.722 CB 1.425 19 residues pruned to eliminate duplicates Z: 17 24.360 2.146 0.573 0.807 1.000 0.562 CB 1.380 17 residues pruned to eliminate duplicates Z: 34 34.080 2.080 0.804 0.627 0.909 0.697 CB 1.543 34 residues pruned to eliminate duplicates Z: 40 41.750 2.228 1.055 0.553 0.872 0.615 CB 1.591 40 residues pruned to eliminate duplicates Z: 6 4.010 1.543 1.000 0.362 0.800 0.600 CB 0.843 4 residues pruned to eliminate duplicates Z: 11 15.442 1.903 0.492 0.817 1.000 0.800 CA 1.307 11 residues pruned to eliminate duplicates Z: 29 43.853 2.347 0.862 0.652 0.964 0.679 CB 1.708 29 residues pruned to eliminate duplicates Z: 13 16.557 2.038 0.780 0.583 0.833 0.500 CB 1.460 13 residues pruned to eliminate duplicates Z: 60 47.588 2.287 0.843 0.529 0.881 0.559 CB 1.621 60 residues pruned to eliminate duplicates Z: 49 40.301 2.059 1.027 0.577 0.896 0.583 CB 1.446 49 residues pruned to eliminate duplicates Z: 32 36.092 2.247 0.774 0.576 0.903 0.645 CB 1.673 32 residues pruned to eliminate duplicates Z: 13 14.424 1.954 0.569 0.794 0.750 0.583 CA 1.400 13 residues pruned to eliminate duplicates Z: 6 2.666 1.628 1.042 0.650 0.800 0.800 N 0.390 Z: 6 10.337 1.819 0.868 0.650 1.000 0.600 N 1.182 Z: 26 35.584 2.289 0.971 0.542 0.920 0.600 CB 1.645 26 residues pruned to eliminate duplicates Z: 8 3.849 1.626 0.439 0.338 0.857 0.571 CB 0.866 Z: 111 70.413 2.281 0.789 0.622 0.936 0.645 CB 1.566 111 residues pruned to eliminate duplicates Z: 59 38.831 2.196 0.438 0.628 0.897 0.638 CB 1.598 67 residues pruned to eliminate duplicates Z: 15 28.631 2.198 0.730 0.910 1.000 0.929 CB 1.427 15 residues pruned to eliminate duplicates Z: 29 28.731 2.348 0.776 0.432 0.893 0.500 CB 1.564 29 residues pruned to eliminate duplicates Z: 16 28.692 2.053 0.733 0.932 1.000 0.467 CB 1.455 16 residues pruned to eliminate duplicates Z: 20 49.304 2.437 0.985 0.916 1.000 0.684 CB 1.652 20 residues pruned to eliminate duplicates Z: 35 28.524 2.123 0.853 0.462 0.882 0.588 CB 1.466 35 residues pruned to eliminate duplicates Z: 22 33.402 2.279 0.808 0.653 0.952 0.714 CB 1.610 22 residues pruned to eliminate duplicates Z: 13 13.406 2.028 0.405 0.347 0.917 0.583 CB 1.750 13 residues pruned to eliminate duplicates Z: 11 10.324 2.024 0.188 0.643 0.900 0.600 CB 1.320 11 residues pruned to eliminate duplicates Z: 18 24.891 2.224 0.712 0.481 0.941 0.529 CB 1.717 18 residues pruned to eliminate duplicates Z: 13 14.726 1.817 0.721 0.757 0.917 0.583 CB 1.180 30 residues pruned to eliminate duplicates Z: 18 25.412 1.947 0.550 0.927 1.000 0.824 CB 1.431 18 residues pruned to eliminate duplicates Z: 15 17.475 1.926 1.010 0.586 0.929 0.857 CB 1.196 15 residues pruned to eliminate duplicates Z: 18 32.127 2.031 0.944 0.924 0.941 0.824 CB 1.473 18 residues pruned to eliminate duplicates Z: 12 15.064 1.894 0.736 0.549 0.909 0.727 CB 1.449 12 residues pruned to eliminate duplicates Z: 9 13.939 2.299 0.517 0.731 0.750 0.625 CA 1.531 9 residues pruned to eliminate duplicates Z: 22 28.612 2.153 0.618 0.801 0.952 0.667 CB 1.446 22 residues pruned to eliminate duplicates Z: 16 36.014 2.371 1.032 0.895 0.933 0.733 CB 1.483 16 residues pruned to eliminate duplicates Z: 10 8.521 1.783 0.496 0.550 0.778 0.444 N 1.304 10 residues pruned to eliminate duplicates Z: 16 22.224 1.924 0.714 0.826 0.933 0.667 CB 1.406 16 residues pruned to eliminate duplicates Z: 24 19.204 1.895 0.740 0.573 0.913 0.609 CB 1.240 24 residues pruned to eliminate duplicates Z: 12 18.234 2.238 0.479 0.580 1.000 0.818 CB 1.537 12 residues pruned to eliminate duplicates Z: 21 11.679 1.812 0.475 0.259 0.950 0.500 CA 1.355 21 residues pruned to eliminate duplicates Z: 10 8.510 1.670 0.426 0.797 0.889 0.667 CB 1.033 10 residues pruned to eliminate duplicates Z: 14 13.190 1.845 0.191 0.923 1.000 1.000 CB 1.169 14 residues pruned to eliminate duplicates Z: 8 12.695 2.064 0.638 0.473 1.000 0.714 CB 1.459 8 residues pruned to eliminate duplicates Z: 20 51.024 2.428 0.995 0.920 0.947 0.632 CB 1.796 20 residues pruned to eliminate duplicates Z: 37 41.647 2.325 0.868 0.577 0.889 0.556 CB 1.669 37 residues pruned to eliminate duplicates Z: 9 16.442 1.891 0.781 0.826 1.000 0.875 CB 1.302 9 residues pruned to eliminate duplicates Z: 13 21.817 2.398 0.798 0.410 0.917 0.750 CA 1.751 13 residues pruned to eliminate duplicates Z: 16 15.995 1.966 0.745 0.524 0.933 0.600 CB 1.259 16 residues pruned to eliminate duplicates Z: 14 11.554 1.914 0.697 0.345 0.846 0.462 CB 1.379 14 residues pruned to eliminate duplicates Z: 10 7.624 1.786 -0.055 0.894 1.000 1.000 CB 1.080 10 residues pruned to eliminate duplicates Z: 19 22.244 2.340 0.800 0.350 0.889 0.389 CB 1.647 19 residues pruned to eliminate duplicates Z: 13 15.577 1.834 0.903 0.465 0.917 0.583 CB 1.457 11 residues pruned to eliminate duplicates Z: 41 40.961 2.340 0.826 0.508 0.950 0.575 CB 1.582 41 residues pruned to eliminate duplicates Z: 23 27.066 2.081 0.789 0.662 1.000 0.682 CB 1.335 23 residues pruned to eliminate duplicates Z: 11 20.134 1.935 0.499 0.911 1.000 0.800 CB 1.556 11 residues pruned to eliminate duplicates Z: 17 22.636 1.984 0.458 0.918 0.938 0.812 CB 1.471 17 residues pruned to eliminate duplicates Z: 38 55.168 2.339 0.734 0.866 0.973 0.784 CB 1.682 38 residues pruned to eliminate duplicates Z: 19 16.946 2.100 0.665 0.534 0.889 0.611 CB 1.243 19 residues pruned to eliminate duplicates Z: 40 35.001 2.181 0.831 0.592 0.897 0.513 CB 1.431 40 residues pruned to eliminate duplicates Z: 26 25.538 1.997 0.873 0.720 0.840 0.680 CB 1.333 26 residues pruned to eliminate duplicates Z: 16 22.862 2.078 0.575 0.922 0.867 0.733 CA 1.464 16 residues pruned to eliminate duplicates Z: 61 52.125 2.312 0.897 0.561 0.917 0.533 CB 1.578 61 residues pruned to eliminate duplicates Z: 34 19.429 1.958 0.532 0.453 0.879 0.667 CB 1.346 23 residues pruned to eliminate duplicates Z: 6 8.251 1.839 0.559 0.646 1.000 0.800 CA 1.123 6 residues pruned to eliminate duplicates Z: 19 14.347 2.123 0.784 0.520 0.833 0.556 CB 1.050 19 residues pruned to eliminate duplicates Z: 47 40.864 2.206 0.877 0.579 0.826 0.435 CB 1.632 47 residues pruned to eliminate duplicates Z: 43 35.918 2.203 0.609 0.712 0.857 0.667 CB 1.505 43 residues pruned to eliminate duplicates Z: 8 3.451 1.400 0.705 0.207 1.000 0.714 CB 0.773 Z: 111 53.940 2.147 0.801 0.543 0.882 0.509 CB 1.447 111 residues pruned to eliminate duplicates Z: 28 43.286 2.380 0.899 0.646 0.926 0.741 CB 1.737 28 residues pruned to eliminate duplicates Z: 11 5.199 1.754 0.695 0.190 0.700 0.300 CB 1.146 11 residues pruned to eliminate duplicates Z: 16 26.013 2.116 0.571 0.919 0.933 0.467 CB 1.525 16 residues pruned to eliminate duplicates Z: 32 32.392 2.289 0.650 0.598 0.903 0.710 CB 1.554 32 residues pruned to eliminate duplicates Z: 16 15.501 2.079 0.464 0.423 0.867 0.600 CB 1.644 16 residues pruned to eliminate duplicates Z: 15 25.171 2.175 0.501 0.895 1.000 0.786 CB 1.478 15 residues pruned to eliminate duplicates Z: 12 7.660 1.794 0.548 0.426 0.818 0.455 CB 1.097 6 residues pruned to eliminate duplicates Z: 23 24.816 2.196 0.661 0.597 0.864 0.682 CB 1.530 23 residues pruned to eliminate duplicates Z: 14 23.471 2.090 0.812 0.895 1.000 0.692 CB 1.232 14 residues pruned to eliminate duplicates Z: 6 3.937 2.101 0.433 0.217 0.600 0.600 CA 1.360 Z: 13 7.011 1.663 0.203 0.549 0.917 0.583 CB 1.052 Z: 19 22.954 1.943 0.832 0.570 1.000 0.722 CB 1.421 19 residues pruned to eliminate duplicates Z: 7 7.290 1.807 0.404 0.587 0.833 0.667 CA 1.296 7 residues pruned to eliminate duplicates Z: 28 30.539 2.219 0.839 0.492 0.889 0.630 CB 1.634 28 residues pruned to eliminate duplicates Z: 16 30.128 2.267 0.797 0.808 0.867 0.600 CB 1.684 16 residues pruned to eliminate duplicates Z: 14 12.462 1.936 0.629 0.446 0.846 0.462 CB 1.370 14 residues pruned to eliminate duplicates Z: 22 32.136 2.222 0.776 0.750 0.952 0.810 CB 1.494 22 residues pruned to eliminate duplicates Z: 64 51.943 2.306 0.800 0.580 0.937 0.698 CB 1.559 64 residues pruned to eliminate duplicates Z: 19 22.412 2.219 0.422 0.833 0.889 0.778 CB 1.414 19 residues pruned to eliminate duplicates Z: 9 4.284 1.778 -0.075 0.552 0.875 0.375 CB 1.001 6 residues pruned to eliminate duplicates Z: 14 10.934 2.042 0.727 0.385 0.615 0.462 CB 1.579 14 residues pruned to eliminate duplicates Z: 48 30.250 2.073 0.982 0.555 0.851 0.574 CB 1.195 48 residues pruned to eliminate duplicates Z: 8 4.871 1.669 0.338 0.303 0.857 0.429 CB 1.198 8 residues pruned to eliminate duplicates Z: 15 13.928 1.813 0.223 0.946 1.000 0.929 CB 1.161 14 residues pruned to eliminate duplicates Z: 10 8.816 1.972 0.312 0.407 0.889 0.444 CB 1.409 10 residues pruned to eliminate duplicates Z: 19 22.695 2.080 0.586 0.676 1.000 0.667 CB 1.378 19 residues pruned to eliminate duplicates 6 1.864 1.241 0.313 0.297 1.000 0.800 CA 0.641 ? Z: 33 36.425 2.221 0.641 0.853 0.906 0.719 CB 1.441 33 residues pruned to eliminate duplicates Z: 18 23.166 1.984 0.348 0.937 1.000 0.941 CA 1.462 18 residues pruned to eliminate duplicates Z: 46 34.598 2.220 0.669 0.510 0.889 0.578 CB 1.550 46 residues pruned to eliminate duplicates Z: 18 19.779 2.123 0.667 0.407 0.941 0.647 CB 1.589 10 residues pruned to eliminate duplicates Z: 33 42.088 2.358 0.873 0.550 0.938 0.812 CA 1.711 33 residues pruned to eliminate duplicates Z: 6 4.601 1.920 -0.005 0.708 1.000 0.800 CB 0.891 Z: 9 10.570 1.519 1.187 0.774 1.000 0.750 CB 0.883 9 residues pruned to eliminate duplicates Z: 10 18.972 1.917 0.620 0.846 1.000 0.778 CB 1.513 10 residues pruned to eliminate duplicates Z: 13 7.578 1.758 0.702 0.241 0.667 0.417 CA 1.479 13 residues pruned to eliminate duplicates Z: 19 17.701 2.226 0.550 0.501 0.667 0.556 CB 1.811 19 residues pruned to eliminate duplicates Z: 39 28.996 2.139 0.615 0.619 0.816 0.526 CB 1.491 39 residues pruned to eliminate duplicates Z: 7 4.228 1.747 0.072 0.350 0.833 0.667 N 1.302 Z: 9 3.538 1.349 0.096 0.344 0.875 0.625 N 1.147 9 residues pruned to eliminate duplicates Z: 33 32.141 2.057 1.080 0.542 0.938 0.625 CB 1.359 17 residues pruned to eliminate duplicates Z: 6 3.477 1.550 0.304 0.579 0.800 0.600 N 0.891 Z: 16 11.934 2.147 0.532 0.420 0.800 0.467 CB 1.273 16 residues pruned to eliminate duplicates Z: 18 33.971 2.225 0.699 0.903 1.000 0.882 CB 1.553 18 residues pruned to eliminate duplicates Z: 19 14.929 1.710 0.890 0.502 0.889 0.444 CA 1.223 19 residues pruned to eliminate duplicates Z: 15 20.276 1.940 0.704 0.817 1.000 0.500 CB 1.245 15 residues pruned to eliminate duplicates Z: 6 3.084 1.389 0.143 0.310 1.000 0.800 CA 1.072 Z: 50 48.309 2.279 0.679 0.651 1.000 0.653 CB 1.567 50 residues pruned to eliminate duplicates Z: 27 14.206 1.800 0.361 0.545 0.885 0.731 CB 1.230 27 residues pruned to eliminate duplicates 6 1.985 1.353 0.573 0.295 1.000 0.400 CB 0.524 ? 7 1.867 2.035 0.157 0.175 0.500 0.500 CB 0.959 ? Z: 13 19.525 1.993 0.884 0.543 0.917 0.833 CB 1.570 13 residues pruned to eliminate duplicates Z: 63 39.362 2.021 0.866 0.516 0.935 0.597 CB 1.394 93 residues pruned to eliminate duplicates Z: 37 32.853 2.099 0.828 0.627 0.944 0.722 CB 1.340 37 residues pruned to eliminate duplicates Z: 34 34.209 2.339 0.547 0.590 0.939 0.667 CB 1.607 34 residues pruned to eliminate duplicates Z: 7 3.584 1.653 0.376 0.200 1.000 0.500 CB 0.919 Z: 16 37.644 2.379 1.100 0.630 1.000 0.600 CB 1.721 16 residues pruned to eliminate duplicates Z: 13 9.331 2.037 0.529 0.374 0.833 0.417 CB 1.187 13 residues pruned to eliminate duplicates Z: 8 3.127 1.747 -0.190 0.217 0.857 0.857 CB 1.358 8 residues pruned to eliminate duplicates Z: 6 3.559 1.449 0.952 0.729 1.000 0.800 CB 0.458 7 1.980 1.775 0.321 0.426 0.667 0.500 CB 0.559 ? Z: 11 16.989 2.179 0.701 0.547 0.900 0.800 CB 1.537 11 residues pruned to eliminate duplicates 6 1.928 1.200 0.587 0.297 0.800 0.400 CA 0.710 ? Z: 12 20.387 2.115 0.806 0.431 1.000 0.818 CA 1.727 12 residues pruned to eliminate duplicates Z: 69 36.158 2.118 0.609 0.589 0.868 0.574 CB 1.362 69 residues pruned to eliminate duplicates Z: 17 34.925 2.048 1.026 0.942 1.000 0.812 CB 1.460 17 residues pruned to eliminate duplicates Z: 10 10.387 1.707 0.641 0.567 1.000 0.778 CB 1.159 Z: 8 3.136 1.564 0.238 0.259 0.714 0.571 CB 1.129 8 residues pruned to eliminate duplicates Z: 14 20.460 2.173 0.484 0.615 0.923 0.769 CA 1.710 14 residues pruned to eliminate duplicates Z: 10 11.499 1.841 0.362 0.821 1.000 1.000 CB 1.157 10 residues pruned to eliminate duplicates Z: 11 6.621 1.688 0.416 0.372 0.800 0.400 CB 1.256 11 residues pruned to eliminate duplicates Z: 13 28.898 2.036 0.954 0.869 1.000 0.667 CB 1.532 Z: 20 23.820 1.979 0.827 0.689 0.947 0.737 CB 1.342 20 residues pruned to eliminate duplicates Z: 6 2.816 1.305 0.814 0.300 0.800 0.600 CB 0.832 Z: 15 24.583 2.131 0.353 0.924 1.000 1.000 CB 1.600 15 residues pruned to eliminate duplicates Z: 24 30.058 2.341 0.674 0.584 0.913 0.696 CB 1.616 24 residues pruned to eliminate duplicates Z: 16 20.865 2.037 0.393 0.868 1.000 0.733 CB 1.388 16 residues pruned to eliminate duplicates Z: 19 24.920 2.437 0.567 0.429 0.944 0.500 CB 1.753 19 residues pruned to eliminate duplicates Z: 6 6.792 1.517 0.433 0.824 1.000 1.000 CA 1.056 6 residues pruned to eliminate duplicates Z: 21 18.122 1.859 0.665 0.575 0.950 0.600 CA 1.282 Z: 85 53.949 2.215 0.689 0.605 0.940 0.690 CB 1.514 85 residues pruned to eliminate duplicates Z: 108 48.621 2.075 0.752 0.552 0.916 0.561 CB 1.341 108 residues pruned to eliminate duplicates Z: 7 10.057 1.830 1.096 0.520 0.833 0.667 N 1.259 Z: 32 23.498 2.023 0.486 0.725 0.903 0.710 CB 1.269 32 residues pruned to eliminate duplicates Z: 13 18.845 2.048 0.790 0.820 0.833 0.500 CB 1.349 13 residues pruned to eliminate duplicates Z: 20 11.951 1.891 0.658 0.492 0.842 0.579 CB 1.047 20 residues pruned to eliminate duplicates Z: 76 49.140 2.215 0.748 0.601 0.907 0.560 CB 1.467 76 residues pruned to eliminate duplicates Z: 9 6.188 1.839 0.510 0.280 0.875 0.500 CB 1.154 Z: 19 21.758 1.952 0.685 0.715 1.000 0.722 CB 1.283 18 residues pruned to eliminate duplicates Z: 11 18.470 1.983 0.881 0.541 0.900 0.600 N 1.671 11 residues pruned to eliminate duplicates Z: 9 3.897 1.405 0.620 0.282 0.875 0.500 CB 0.885 Z: 14 16.229 2.184 0.740 0.434 0.923 0.615 CB 1.374 14 residues pruned to eliminate duplicates Z: 16 28.502 2.121 0.639 0.934 0.933 0.667 CB 1.582 16 residues pruned to eliminate duplicates Z: 17 23.578 1.944 0.391 0.938 1.000 0.938 CB 1.517 17 residues pruned to eliminate duplicates Z: 24 17.770 1.861 0.851 0.574 0.826 0.739 CB 1.213 24 residues pruned to eliminate duplicates Z: 6 2.026 1.405 0.341 0.470 0.800 0.600 CB 0.620 Z: 31 26.517 1.931 0.864 0.630 0.933 0.633 CB 1.276 54 residues pruned to eliminate duplicates Z: 19 32.703 2.386 0.688 0.555 1.000 0.722 CB 1.815 19 residues pruned to eliminate duplicates Z: 14 8.577 1.683 0.488 0.486 0.923 0.538 CB 1.044 14 residues pruned to eliminate duplicates Z: 6 3.758 1.912 -0.363 0.799 1.000 1.000 CB 1.063 8 residues pruned to eliminate duplicates Z: 11 12.351 1.959 0.359 0.913 1.000 0.700 CB 1.039 11 residues pruned to eliminate duplicates Z: 10 11.584 1.762 0.535 0.586 1.000 0.667 CA 1.315 10 residues pruned to eliminate duplicates Z: 9 10.990 2.000 0.398 0.786 0.875 0.500 CB 1.235 9 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 17 26.214 2.081 0.604 0.882 0.938 0.875 CB 1.515 17 residues pruned to eliminate duplicates Z: 17 24.192 2.010 0.708 0.892 0.875 0.875 CB 1.446 17 residues pruned to eliminate duplicates Z: 17 31.672 2.064 0.771 0.920 1.000 0.750 CB 1.525 17 residues pruned to eliminate duplicates Z: 18 20.799 1.941 0.290 0.920 0.941 0.647 CB 1.506 17 residues pruned to eliminate duplicates Z: 18 23.197 1.970 0.395 0.897 1.000 0.765 CB 1.465 18 residues pruned to eliminate duplicates Z: 18 25.732 1.993 0.575 0.876 1.000 0.765 CB 1.445 18 residues pruned to eliminate duplicates Z: 16 32.478 2.150 0.820 0.944 0.933 0.800 CB 1.590 16 residues pruned to eliminate duplicates Z: 16 28.847 2.036 0.690 0.922 1.000 0.733 CB 1.522 16 residues pruned to eliminate duplicates Z: 16 30.276 2.141 0.722 0.954 0.933 0.533 CB 1.563 16 residues pruned to eliminate duplicates Z: 17 30.840 2.072 0.722 0.935 1.000 0.688 CB 1.506 17 residues pruned to eliminate duplicates Z: 17 30.956 2.068 0.742 0.937 1.000 0.750 CB 1.495 17 residues pruned to eliminate duplicates Z: 16 25.828 2.069 0.740 0.860 0.867 0.533 CB 1.572 16 residues pruned to eliminate duplicates Z: 16 36.495 2.140 0.968 0.951 1.000 0.600 CB 1.542 16 residues pruned to eliminate duplicates Z: 16 28.292 2.123 0.684 0.952 0.933 0.267 CB 1.508 16 residues pruned to eliminate duplicates Z: 26 48.318 2.462 0.728 0.687 1.000 0.800 CB 1.914 26 residues pruned to eliminate duplicates Z: 29 51.202 2.391 1.014 0.623 1.000 0.714 CB 1.790 29 residues pruned to eliminate duplicates Z: 15 42.606 2.397 1.337 0.872 0.857 0.857 CB 1.728 15 residues pruned to eliminate duplicates Z: 28 49.934 2.422 0.922 0.622 1.000 0.741 CB 1.840 28 residues pruned to eliminate duplicates Z: 29 44.013 2.400 0.874 0.611 0.929 0.714 CB 1.793 29 residues pruned to eliminate duplicates Z: 30 36.348 2.250 0.829 0.556 0.897 0.690 CB 1.732 30 residues pruned to eliminate duplicates Z: 19 39.240 2.302 1.026 0.726 0.944 0.889 CB 1.713 19 residues pruned to eliminate duplicates Z: 30 47.318 2.343 0.961 0.603 0.966 0.724 CB 1.796 29 residues pruned to eliminate duplicates Z: 16 52.478 2.421 1.196 0.908 1.000 0.800 CB 1.811 16 residues pruned to eliminate duplicates Z: 30 48.523 2.350 0.927 0.601 1.000 0.759 CA 1.807 31 residues pruned to eliminate duplicates Z: 15 40.464 2.293 1.192 0.905 0.929 0.786 CB 1.649 15 residues pruned to eliminate duplicates Z: 29 49.026 2.406 0.899 0.608 1.000 0.786 CB 1.829 29 residues pruned to eliminate duplicates Z: 32 40.859 2.244 0.900 0.577 0.935 0.742 CB 1.709 32 residues pruned to eliminate duplicates Z: 30 42.979 2.338 0.802 0.597 0.966 0.690 CB 1.788 30 residues pruned to eliminate duplicates Z: 30 44.450 2.326 0.855 0.587 1.000 0.759 CA 1.760 30 residues pruned to eliminate duplicates Z: 30 43.894 2.334 0.866 0.585 0.966 0.793 CB 1.788 30 residues pruned to eliminate duplicates Z: 27 52.009 2.484 0.955 0.656 0.962 0.731 CB 1.889 27 residues pruned to eliminate duplicates Z: 27 44.100 2.472 0.679 0.655 0.962 0.731 CB 1.876 27 residues pruned to eliminate duplicates Z: 30 48.250 2.360 0.963 0.604 0.966 0.759 CB 1.814 29 residues pruned to eliminate duplicates Z: 6 5.144 1.653 0.922 0.304 1.000 0.400 CA 0.901 6 residues pruned to eliminate duplicates Z: 30 46.677 2.332 0.889 0.599 1.000 0.690 CB 1.791 31 residues pruned to eliminate duplicates Z: 7 6.146 1.467 0.637 0.428 1.000 0.500 CA 1.126 7 residues pruned to eliminate duplicates Z: 29 46.772 2.401 0.884 0.606 0.964 0.714 CB 1.831 29 residues pruned to eliminate duplicates Z: 30 45.969 2.366 0.974 0.589 0.931 0.724 CB 1.802 30 residues pruned to eliminate duplicates Z: 29 43.251 2.360 0.826 0.609 0.929 0.750 CB 1.842 29 residues pruned to eliminate duplicates Z: 23 18.631 2.214 0.735 0.419 0.864 0.545 CB 1.303 33 residues pruned to eliminate duplicates Z: 6 3.671 1.615 0.293 0.380 1.000 0.400 CA 0.894 6 residues pruned to eliminate duplicates Z: 17 25.032 2.280 0.770 0.497 0.938 0.438 CB 1.659 17 residues pruned to eliminate duplicates Z: 16 23.450 2.307 0.752 0.502 0.933 0.533 CB 1.602 17 residues pruned to eliminate duplicates Z: 6 5.674 1.785 0.916 0.274 0.800 0.400 CA 1.198 6 residues pruned to eliminate duplicates Z: 18 21.119 2.119 0.861 0.494 0.882 0.529 CB 1.481 18 residues pruned to eliminate duplicates Z: 17 22.539 2.271 0.757 0.517 0.875 0.625 CB 1.588 17 residues pruned to eliminate duplicates Z: 18 22.779 2.333 0.841 0.420 0.882 0.588 CB 1.585 18 residues pruned to eliminate duplicates Z: 22 19.793 2.128 0.705 0.408 0.905 0.381 CB 1.449 22 residues pruned to eliminate duplicates Z: 17 19.481 2.278 0.939 0.443 0.812 0.500 CB 1.438 17 residues pruned to eliminate duplicates Z: 46 41.788 2.301 0.717 0.544 0.933 0.644 CB 1.619 65 residues pruned to eliminate duplicates Z: 53 39.970 2.287 0.624 0.513 0.904 0.577 CB 1.630 53 residues pruned to eliminate duplicates Z: 19 22.400 2.182 0.708 0.461 0.944 0.611 CB 1.560 Z: 8 4.419 1.642 0.052 0.419 0.857 0.571 N 1.226 8 residues pruned to eliminate duplicates Z: 16 19.316 2.027 0.793 0.492 0.933 0.533 CB 1.482 23 residues pruned to eliminate duplicates Z: 7 3.715 1.821 -0.024 0.364 0.833 0.500 CA 1.185 7 residues pruned to eliminate duplicates Z: 14 12.373 1.849 0.579 0.473 0.923 0.462 CA 1.309 14 residues pruned to eliminate duplicates Z: 17 13.831 1.916 0.641 0.455 0.875 0.500 CA 1.316 17 residues pruned to eliminate duplicates Z: 14 15.451 1.964 0.780 0.521 0.923 0.615 CB 1.300 14 residues pruned to eliminate duplicates Z: 10 10.539 1.949 0.535 0.351 0.778 0.444 CA 1.775 10 residues pruned to eliminate duplicates Z: 14 13.402 1.985 0.521 0.398 0.846 0.615 CA 1.619 35 residues pruned to eliminate duplicates Z: 12 11.066 1.990 0.594 0.307 0.818 0.727 CA 1.592 Z: 9 3.761 1.287 0.376 0.489 0.875 0.750 CA 0.868 3 residues pruned to eliminate duplicates Z: 9 10.771 1.752 0.508 0.753 1.000 0.750 CA 1.150 8 residues pruned to eliminate duplicates Z: 9 12.618 1.840 0.546 0.896 1.000 0.750 CA 1.123 9 residues pruned to eliminate duplicates Z: 26 17.072 1.774 0.803 0.436 0.960 0.520 CB 1.188 27 residues pruned to eliminate duplicates Z: 8 14.193 1.881 0.760 0.882 1.000 0.857 CA 1.173 8 residues pruned to eliminate duplicates Z: 20 23.917 1.977 0.874 0.559 1.000 0.526 CB 1.398 20 residues pruned to eliminate duplicates Z: 8 15.213 1.855 0.826 0.883 1.000 0.714 CA 1.227 8 residues pruned to eliminate duplicates Z: 20 24.719 1.988 0.878 0.569 1.000 0.579 CB 1.421 20 residues pruned to eliminate duplicates Z: 12 16.481 1.843 0.881 0.711 1.000 0.636 CB 1.184 12 residues pruned to eliminate duplicates Z: 21 21.207 1.889 0.852 0.562 0.950 0.450 CB 1.344 21 residues pruned to eliminate duplicates Z: 20 21.995 1.970 0.862 0.534 1.000 0.579 CB 1.331 20 residues pruned to eliminate duplicates Z: 21 22.315 1.921 0.865 0.550 1.000 0.500 CB 1.326 21 residues pruned to eliminate duplicates Z: 9 11.011 1.831 0.488 0.560 0.875 0.375 CA 1.540 9 residues pruned to eliminate duplicates Z: 21 20.929 1.898 0.766 0.538 1.000 0.700 CB 1.346 21 residues pruned to eliminate duplicates Z: 6 4.350 1.383 0.488 0.454 1.000 0.600 CB 0.991 6 residues pruned to eliminate duplicates Z: 20 22.959 1.983 0.853 0.531 1.000 0.579 CB 1.390 20 residues pruned to eliminate duplicates Z: 19 28.766 2.181 0.842 0.529 1.000 0.778 CB 1.641 23 residues pruned to eliminate duplicates Z: 12 14.394 1.737 0.620 0.780 1.000 0.636 CB 1.204 12 residues pruned to eliminate duplicates Z: 18 28.551 2.205 0.853 0.500 1.000 0.706 CB 1.695 18 residues pruned to eliminate duplicates Z: 12 13.831 1.730 0.599 0.775 1.000 0.727 CB 1.182 12 residues pruned to eliminate duplicates Z: 21 16.755 2.050 0.844 0.305 0.850 0.500 CB 1.449 21 residues pruned to eliminate duplicates Z: 22 22.235 2.048 0.849 0.409 0.905 0.667 CB 1.559 18 residues pruned to eliminate duplicates Z: 11 11.846 1.863 0.511 0.762 0.900 0.800 CA 1.172 11 residues pruned to eliminate duplicates Z: 19 23.202 2.092 0.782 0.498 0.944 0.778 CB 1.557 19 residues pruned to eliminate duplicates Z: 17 23.890 2.217 0.761 0.450 1.000 0.812 CA 1.609 17 residues pruned to eliminate duplicates Z: 19 23.795 2.106 0.741 0.510 0.944 0.833 CB 1.603 19 residues pruned to eliminate duplicates Z: 22 24.130 2.112 0.707 0.426 0.952 0.667 CB 1.656 22 residues pruned to eliminate duplicates Z: 6 6.249 1.923 0.578 0.300 0.800 0.800 CA 1.439 6 residues pruned to eliminate duplicates Z: 21 25.337 2.001 0.775 0.502 1.000 0.650 CB 1.592 22 residues pruned to eliminate duplicates Z: 14 10.099 1.762 -0.004 0.885 1.000 0.846 CB 1.153 14 residues pruned to eliminate duplicates Z: 6 6.371 1.783 0.008 0.890 1.000 1.000 CB 1.140 6 residues pruned to eliminate duplicates Z: 16 14.672 1.807 0.277 0.929 1.000 0.933 CB 1.149 16 residues pruned to eliminate duplicates Z: 16 14.733 1.810 0.275 0.935 1.000 0.933 CB 1.148 16 residues pruned to eliminate duplicates Z: 16 17.639 1.804 0.554 0.943 1.000 0.933 CB 1.126 16 residues pruned to eliminate duplicates Z: 16 17.035 1.805 0.517 0.949 1.000 0.933 CB 1.109 16 residues pruned to eliminate duplicates Z: 15 16.666 1.818 0.622 0.951 1.000 0.857 CB 1.041 15 residues pruned to eliminate duplicates Z: 16 16.877 1.795 0.558 0.942 1.000 0.733 CB 1.081 17 residues pruned to eliminate duplicates Z: 13 16.260 1.901 0.521 0.947 1.000 0.833 CB 1.122 13 residues pruned to eliminate duplicates Z: 16 17.181 1.801 0.527 0.939 1.000 0.867 CB 1.121 16 residues pruned to eliminate duplicates Z: 16 17.064 1.776 0.628 0.918 1.000 0.600 CB 1.075 16 residues pruned to eliminate duplicates Z: 15 15.946 1.830 0.464 0.915 1.000 0.643 CB 1.124 15 residues pruned to eliminate duplicates 6 0.770 1.527 -0.217 0.286 1.000 0.600 CB 0.367 ? Z: 14 20.985 2.172 0.668 0.484 1.000 0.846 CB 1.633 14 residues pruned to eliminate duplicates Z: 15 20.226 2.082 0.653 0.483 1.000 0.786 CB 1.598 15 residues pruned to eliminate duplicates Z: 15 16.830 2.154 0.637 0.351 0.929 0.643 CB 1.615 15 residues pruned to eliminate duplicates Z: 14 20.842 2.166 0.858 0.403 1.000 0.615 CB 1.590 14 residues pruned to eliminate duplicates Z: 16 15.786 2.053 0.757 0.385 0.867 0.533 CB 1.473 16 residues pruned to eliminate duplicates Z: 14 21.032 2.192 0.768 0.396 1.000 0.692 CB 1.680 14 residues pruned to eliminate duplicates Z: 14 20.334 2.185 0.912 0.385 0.923 0.692 CB 1.652 14 residues pruned to eliminate duplicates Z: 13 21.269 2.296 0.917 0.418 0.917 0.750 CB 1.658 13 residues pruned to eliminate duplicates Z: 15 18.597 2.081 0.771 0.422 0.929 0.643 CB 1.575 15 residues pruned to eliminate duplicates Z: 13 18.558 2.069 0.998 0.455 0.917 0.583 CB 1.481 13 residues pruned to eliminate duplicates Z: 36 29.521 2.161 0.712 0.411 0.914 0.514 CB 1.619 36 residues pruned to eliminate duplicates Z: 40 31.019 2.204 0.783 0.387 0.897 0.436 CB 1.587 40 residues pruned to eliminate duplicates Z: 30 25.022 2.316 0.691 0.376 0.828 0.310 CB 1.638 30 residues pruned to eliminate duplicates Z: 19 30.178 2.474 0.620 0.440 1.000 0.500 CA 1.889 19 residues pruned to eliminate duplicates Z: 32 30.233 2.379 0.641 0.405 0.903 0.484 CB 1.701 32 residues pruned to eliminate duplicates Z: 20 32.901 2.454 0.803 0.465 0.947 0.579 CB 1.866 20 residues pruned to eliminate duplicates Z: 21 27.423 2.339 0.731 0.468 0.900 0.600 CB 1.739 21 residues pruned to eliminate duplicates Z: 32 23.897 2.255 0.760 0.340 0.806 0.452 CB 1.596 32 residues pruned to eliminate duplicates Z: 26 31.534 2.401 0.814 0.412 0.920 0.480 CB 1.726 26 residues pruned to eliminate duplicates Z: 18 26.733 2.500 0.738 0.483 0.824 0.471 CB 1.842 18 residues pruned to eliminate duplicates Z: 25 37.517 2.471 0.814 0.479 0.958 0.500 CB 1.821 25 residues pruned to eliminate duplicates Z: 19 34.826 2.469 0.949 0.491 0.944 0.444 CA 1.823 19 residues pruned to eliminate duplicates Z: 35 27.772 2.310 0.772 0.369 0.824 0.441 CB 1.626 35 residues pruned to eliminate duplicates Z: 20 38.520 2.458 0.869 0.524 1.000 0.579 CB 1.879 20 residues pruned to eliminate duplicates Z: 39 37.737 2.306 0.815 0.458 0.895 0.500 CB 1.706 39 residues pruned to eliminate duplicates Z: 45 43.423 2.350 0.855 0.488 0.932 0.523 CB 1.631 45 residues pruned to eliminate duplicates Z: 34 32.342 2.255 0.948 0.415 0.879 0.606 CB 1.594 34 residues pruned to eliminate duplicates Z: 35 32.668 2.231 0.969 0.440 0.853 0.529 CB 1.592 35 residues pruned to eliminate duplicates Z: 25 41.653 2.491 0.887 0.504 0.958 0.458 CB 1.880 25 residues pruned to eliminate duplicates Z: 30 38.941 2.443 0.800 0.471 0.966 0.414 CB 1.754 30 residues pruned to eliminate duplicates Z: 32 32.448 2.389 0.883 0.444 0.871 0.484 CB 1.576 32 residues pruned to eliminate duplicates Z: 21 24.419 2.459 0.703 0.388 0.850 0.400 CB 1.728 21 residues pruned to eliminate duplicates Z: 14 20.419 2.297 0.905 0.497 0.846 0.308 CB 1.534 14 residues pruned to eliminate duplicates Z: 14 18.064 2.300 0.919 0.357 0.846 0.385 CB 1.566 14 residues pruned to eliminate duplicates Z: 90 61.706 2.224 0.907 0.578 0.933 0.596 CB 1.534 90 residues pruned to eliminate duplicates Z: 6 13.127 2.222 0.702 0.640 0.800 0.800 CB 1.703 6 residues pruned to eliminate duplicates Z: 50 43.534 2.246 0.908 0.518 0.878 0.653 CB 1.624 50 residues pruned to eliminate duplicates Z: 74 57.850 2.292 0.891 0.577 0.945 0.575 CB 1.534 74 residues pruned to eliminate duplicates Z: 38 33.454 2.286 0.766 0.493 0.892 0.541 CB 1.538 38 residues pruned to eliminate duplicates Z: 28 25.928 2.182 0.742 0.500 0.926 0.630 CB 1.417 28 residues pruned to eliminate duplicates Z: 112 57.512 2.159 0.785 0.546 0.901 0.577 CB 1.503 112 residues pruned to eliminate duplicates Z: 75 48.191 2.228 0.758 0.547 0.892 0.514 CB 1.532 75 residues pruned to eliminate duplicates Z: 71 51.761 2.241 0.831 0.593 0.914 0.571 CB 1.508 71 residues pruned to eliminate duplicates Z: 75 55.332 2.258 0.840 0.592 0.932 0.568 CB 1.520 75 residues pruned to eliminate duplicates Z: 95 54.757 2.195 0.792 0.562 0.883 0.628 CB 1.532 95 residues pruned to eliminate duplicates Z: 71 50.707 2.231 0.786 0.573 0.943 0.557 CB 1.503 71 residues pruned to eliminate duplicates Z: 91 57.756 2.269 0.846 0.546 0.900 0.622 CB 1.544 91 residues pruned to eliminate duplicates Z: 71 52.560 2.253 0.821 0.601 0.914 0.529 CB 1.521 71 residues pruned to eliminate duplicates Z: 73 55.509 2.284 0.832 0.592 0.958 0.583 CB 1.493 73 residues pruned to eliminate duplicates Z: 99 55.430 2.203 0.805 0.560 0.908 0.592 CB 1.464 99 residues pruned to eliminate duplicates Z: 29 21.584 2.153 0.678 0.527 0.786 0.500 CB 1.399 29 residues pruned to eliminate duplicates Z: 95 55.819 2.196 0.862 0.571 0.904 0.606 CB 1.454 95 residues pruned to eliminate duplicates Z: 76 47.955 2.231 0.814 0.534 0.893 0.587 CB 1.482 76 residues pruned to eliminate duplicates Z: 90 52.047 2.262 0.835 0.516 0.843 0.494 CB 1.553 90 residues pruned to eliminate duplicates Z: 106 54.599 2.189 0.786 0.541 0.867 0.571 CB 1.511 106 residues pruned to eliminate duplicates Z: 85 52.527 2.247 0.755 0.572 0.869 0.595 CB 1.561 85 residues pruned to eliminate duplicates Z: 74 47.895 2.240 0.789 0.557 0.904 0.548 CB 1.464 74 residues pruned to eliminate duplicates Z: 76 53.349 2.258 0.817 0.580 0.920 0.547 CB 1.511 76 residues pruned to eliminate duplicates Z: 98 53.994 2.176 0.806 0.550 0.907 0.619 CB 1.463 98 residues pruned to eliminate duplicates Z: 105 55.825 2.208 0.735 0.541 0.913 0.567 CB 1.504 105 residues pruned to eliminate duplicates Z: 115 59.592 2.201 0.780 0.543 0.912 0.596 CB 1.497 115 residues pruned to eliminate duplicates Z: 75 52.711 2.256 0.859 0.574 0.892 0.581 CB 1.525 75 residues pruned to eliminate duplicates Z: 95 51.502 2.186 0.711 0.586 0.894 0.596 CB 1.464 95 residues pruned to eliminate duplicates Z: 49 27.394 2.116 0.592 0.450 0.896 0.500 CB 1.379 49 residues pruned to eliminate duplicates Z: 49 36.041 2.220 0.700 0.494 0.896 0.583 CB 1.548 49 residues pruned to eliminate duplicates Z: 105 57.621 2.194 0.784 0.562 0.904 0.625 CB 1.504 105 residues pruned to eliminate duplicates Z: 83 50.733 2.225 0.783 0.541 0.890 0.585 CB 1.524 83 residues pruned to eliminate duplicates Z: 81 52.862 2.216 0.806 0.576 0.913 0.588 CB 1.505 81 residues pruned to eliminate duplicates Z: 94 52.643 2.179 0.715 0.588 0.935 0.581 CB 1.435 94 residues pruned to eliminate duplicates Z: 49 35.765 2.295 0.759 0.483 0.812 0.542 CB 1.600 49 residues pruned to eliminate duplicates Z: 72 52.419 2.265 0.813 0.605 0.901 0.577 CB 1.522 72 residues pruned to eliminate duplicates Z: 80 54.420 2.258 0.767 0.564 0.924 0.608 CB 1.560 80 residues pruned to eliminate duplicates Z: 86 50.798 2.181 0.778 0.564 0.918 0.624 CB 1.454 86 residues pruned to eliminate duplicates Z: 99 55.276 2.204 0.781 0.565 0.918 0.622 CB 1.455 99 residues pruned to eliminate duplicates Z: 78 46.525 2.177 0.737 0.559 0.909 0.610 CB 1.456 78 residues pruned to eliminate duplicates Z: 72 56.853 2.283 0.938 0.584 0.915 0.577 CB 1.536 72 residues pruned to eliminate duplicates Z: 71 57.767 2.295 0.880 0.606 0.943 0.629 CB 1.535 71 residues pruned to eliminate duplicates Z: 105 56.436 2.195 0.809 0.548 0.894 0.587 CB 1.487 105 residues pruned to eliminate duplicates Z: 116 58.704 2.199 0.784 0.532 0.913 0.591 CB 1.480 116 residues pruned to eliminate duplicates Z: 86 59.007 2.248 0.865 0.584 0.906 0.624 CB 1.555 86 residues pruned to eliminate duplicates Z: 73 50.577 2.258 0.790 0.575 0.917 0.569 CB 1.496 73 residues pruned to eliminate duplicates Z: 112 58.053 2.191 0.762 0.554 0.928 0.604 CB 1.459 112 residues pruned to eliminate duplicates Z: 99 52.915 2.152 0.732 0.575 0.918 0.633 CB 1.452 99 residues pruned to eliminate duplicates Z: 69 54.884 2.281 0.882 0.603 0.926 0.588 CB 1.517 69 residues pruned to eliminate duplicates Z: 95 55.383 2.164 0.803 0.565 0.957 0.660 CB 1.435 95 residues pruned to eliminate duplicates Z: 23 28.518 2.103 0.899 0.610 1.000 0.636 CB 1.371 23 residues pruned to eliminate duplicates Z: 75 55.209 2.261 0.852 0.591 0.959 0.608 CB 1.464 75 residues pruned to eliminate duplicates Z: 79 51.962 2.258 0.741 0.559 0.923 0.577 CB 1.532 79 residues pruned to eliminate duplicates Z: 58 40.027 2.094 0.798 0.601 0.947 0.667 CB 1.350 58 residues pruned to eliminate duplicates Z: 86 52.193 2.213 0.813 0.575 0.918 0.588 CB 1.431 86 residues pruned to eliminate duplicates Z: 81 54.559 2.270 0.859 0.578 0.900 0.688 CB 1.491 81 residues pruned to eliminate duplicates Z: 82 49.855 2.170 0.802 0.533 0.926 0.543 CB 1.482 82 residues pruned to eliminate duplicates Z: 71 52.897 2.256 0.890 0.583 0.943 0.614 CB 1.453 71 residues pruned to eliminate duplicates Z: 92 54.756 2.244 0.827 0.526 0.912 0.549 CB 1.496 92 residues pruned to eliminate duplicates Z: 20 14.804 1.817 0.679 0.525 0.895 0.526 CB 1.214 20 residues pruned to eliminate duplicates Z: 36 27.540 2.024 0.713 0.587 0.971 0.657 CB 1.271 36 residues pruned to eliminate duplicates Z: 75 47.611 2.222 0.748 0.571 0.932 0.595 CB 1.428 75 residues pruned to eliminate duplicates Z: 95 52.807 2.184 0.815 0.554 0.904 0.564 CB 1.441 95 residues pruned to eliminate duplicates Z: 82 53.142 2.245 0.776 0.556 0.938 0.580 CB 1.495 82 residues pruned to eliminate duplicates Z: 82 58.883 2.277 0.842 0.565 0.951 0.580 CB 1.540 82 residues pruned to eliminate duplicates Z: 81 56.505 2.281 0.891 0.563 0.900 0.600 CB 1.531 81 residues pruned to eliminate duplicates Z: 87 53.476 2.191 0.834 0.580 0.919 0.570 CB 1.446 87 residues pruned to eliminate duplicates Z: 99 57.362 2.185 0.885 0.564 0.918 0.612 CB 1.440 99 residues pruned to eliminate duplicates Z: 15 14.701 1.930 0.724 0.788 1.000 0.714 CB 0.917 15 residues pruned to eliminate duplicates Z: 74 52.530 2.259 0.821 0.581 0.932 0.589 CB 1.484 74 residues pruned to eliminate duplicates Z: 100 56.225 2.187 0.806 0.569 0.929 0.626 CB 1.440 100 residues pruned to eliminate duplicates Z: 60 37.814 2.074 0.841 0.586 0.881 0.610 CB 1.347 60 residues pruned to eliminate duplicates Z: 6 4.048 1.405 0.738 0.313 1.000 0.600 CB 0.912 6 residues pruned to eliminate duplicates Z: 28 18.495 1.925 0.705 0.499 0.889 0.667 CB 1.221 29 residues pruned to eliminate duplicates Z: 6 3.157 1.449 -0.042 0.409 1.000 0.800 CA 1.120 6 residues pruned to eliminate duplicates Z: 17 11.437 1.733 0.478 0.478 0.938 0.688 CB 1.217 17 residues pruned to eliminate duplicates Z: 34 15.261 1.822 0.512 0.422 0.909 0.515 CB 1.150 34 residues pruned to eliminate duplicates Z: 88 57.423 2.209 0.847 0.584 0.943 0.598 CB 1.477 88 residues pruned to eliminate duplicates Z: 94 53.539 2.193 0.821 0.567 0.914 0.559 CB 1.426 94 residues pruned to eliminate duplicates Z: 27 17.658 1.955 0.484 0.509 0.885 0.615 CB 1.337 27 residues pruned to eliminate duplicates Z: 98 50.277 2.184 0.735 0.558 0.887 0.526 CB 1.436 98 residues pruned to eliminate duplicates Z: 18 13.850 1.962 0.546 0.549 0.824 0.706 CB 1.282 18 residues pruned to eliminate duplicates Z: 95 53.831 2.176 0.821 0.566 0.915 0.543 CB 1.437 95 residues pruned to eliminate duplicates Z: 30 15.631 1.921 0.508 0.462 0.828 0.586 CB 1.259 30 residues pruned to eliminate duplicates Z: 95 50.957 2.167 0.781 0.564 0.926 0.606 CB 1.383 95 residues pruned to eliminate duplicates Z: 28 17.656 1.910 0.579 0.520 0.889 0.593 CB 1.243 28 residues pruned to eliminate duplicates Z: 98 53.825 2.167 0.825 0.566 0.897 0.567 CB 1.445 98 residues pruned to eliminate duplicates Z: 61 36.711 2.068 0.818 0.588 0.900 0.550 CB 1.287 61 residues pruned to eliminate duplicates Z: 98 49.349 2.174 0.803 0.548 0.856 0.526 CB 1.425 98 residues pruned to eliminate duplicates Z: 18 15.495 1.969 0.653 0.576 0.824 0.706 CB 1.303 18 residues pruned to eliminate duplicates Z: 27 18.171 1.947 0.569 0.519 0.885 0.692 CB 1.294 27 residues pruned to eliminate duplicates Z: 19 15.091 1.960 0.700 0.520 0.833 0.667 CB 1.256 19 residues pruned to eliminate duplicates Z: 28 17.089 1.880 0.535 0.491 0.926 0.593 CB 1.241 28 residues pruned to eliminate duplicates Z: 59 39.242 2.105 0.777 0.604 0.931 0.569 CB 1.340 59 residues pruned to eliminate duplicates Z: 99 54.938 2.195 0.756 0.578 0.908 0.602 CB 1.471 99 residues pruned to eliminate duplicates Z: 8 6.885 1.837 0.741 0.606 0.714 0.714 CB 1.030 8 residues pruned to eliminate duplicates Z: 19 15.662 2.065 0.712 0.456 0.833 0.500 CB 1.310 19 residues pruned to eliminate duplicates Z: 45 34.930 2.177 0.731 0.610 0.886 0.591 CB 1.420 45 residues pruned to eliminate duplicates Z: 14 12.619 1.986 0.704 0.505 0.846 0.615 CB 1.216 14 residues pruned to eliminate duplicates Z: 15 9.824 1.989 0.559 0.392 0.857 0.429 CB 1.108 15 residues pruned to eliminate duplicates Z: 12 10.340 1.979 0.754 0.497 0.818 0.455 CB 1.100 12 residues pruned to eliminate duplicates Z: 41 36.761 2.194 0.861 0.633 0.875 0.550 CB 1.435 42 residues pruned to eliminate duplicates Z: 7 7.138 1.590 0.629 0.432 1.000 0.667 CA 1.206 7 residues pruned to eliminate duplicates Z: 55 37.201 2.172 0.681 0.643 0.852 0.630 CB 1.424 54 residues pruned to eliminate duplicates Z: 7 6.036 1.587 0.189 0.455 1.000 0.333 O 1.367 7 residues pruned to eliminate duplicates Z: 7 3.947 2.150 -0.016 0.158 0.667 0.167 CA 1.737 7 residues pruned to eliminate duplicates Z: 13 10.280 2.134 0.643 0.211 0.750 0.333 CB 1.586 13 residues pruned to eliminate duplicates Z: 42 34.450 2.203 0.693 0.613 0.878 0.610 CB 1.475 42 residues pruned to eliminate duplicates Z: 123 54.725 2.151 0.717 0.585 0.869 0.607 CB 1.423 123 residues pruned to eliminate duplicates Z: 23 40.822 2.285 0.801 0.778 1.000 0.727 CB 1.656 23 residues pruned to eliminate duplicates Z: 31 39.258 2.294 0.818 0.603 0.933 0.700 CB 1.669 31 residues pruned to eliminate duplicates Z: 23 33.329 2.241 0.768 0.841 0.909 0.727 CB 1.471 23 residues pruned to eliminate duplicates Z: 22 38.925 2.207 0.940 0.800 0.952 0.762 CB 1.602 22 residues pruned to eliminate duplicates Z: 22 38.332 2.254 1.017 0.844 0.952 0.714 CB 1.437 22 residues pruned to eliminate duplicates Z: 56 40.753 2.151 0.675 0.646 0.927 0.673 CB 1.435 56 residues pruned to eliminate duplicates Z: 35 33.394 2.119 0.647 0.835 0.882 0.676 CB 1.393 35 residues pruned to eliminate duplicates Z: 43 35.793 2.167 0.569 0.688 0.905 0.571 CB 1.511 43 residues pruned to eliminate duplicates Z: 23 44.872 2.299 0.908 0.813 1.000 0.864 CB 1.661 23 residues pruned to eliminate duplicates Z: 33 31.448 2.208 0.697 0.584 0.906 0.781 CB 1.511 33 residues pruned to eliminate duplicates Z: 21 42.836 2.316 0.837 0.885 1.000 0.900 CB 1.626 21 residues pruned to eliminate duplicates Z: 23 39.293 2.261 0.860 0.759 1.000 0.773 CB 1.582 23 residues pruned to eliminate duplicates Z: 23 39.686 2.306 0.712 0.796 1.000 0.818 CB 1.654 23 residues pruned to eliminate duplicates Z: 23 36.199 2.229 0.748 0.794 0.955 0.773 CB 1.604 23 residues pruned to eliminate duplicates Z: 40 35.991 2.204 0.619 0.618 0.923 0.692 CB 1.565 40 residues pruned to eliminate duplicates Z: 69 39.440 2.150 0.590 0.615 0.926 0.691 CB 1.354 69 residues pruned to eliminate duplicates Z: 23 38.086 2.266 0.738 0.769 1.000 0.864 CB 1.625 23 residues pruned to eliminate duplicates Z: 35 38.428 2.196 0.629 0.814 0.971 0.765 CB 1.444 35 residues pruned to eliminate duplicates Z: 35 32.897 2.195 0.444 0.798 0.971 0.735 CB 1.413 35 residues pruned to eliminate duplicates Z: 35 37.130 2.222 0.701 0.825 0.882 0.765 CB 1.441 35 residues pruned to eliminate duplicates Z: 36 39.415 2.201 0.703 0.787 0.971 0.771 CB 1.422 36 residues pruned to eliminate duplicates Z: 113 51.023 2.155 0.592 0.634 0.902 0.688 CB 1.374 113 residues pruned to eliminate duplicates Z: 69 46.437 2.188 0.626 0.688 0.941 0.735 CB 1.416 69 residues pruned to eliminate duplicates Z: 44 40.374 2.214 0.582 0.664 0.977 0.628 CB 1.546 44 residues pruned to eliminate duplicates Z: 100 47.003 2.155 0.587 0.590 0.909 0.636 CB 1.394 100 residues pruned to eliminate duplicates Z: 50 36.845 2.163 0.596 0.613 0.918 0.592 CB 1.492 50 residues pruned to eliminate duplicates Z: 34 40.269 2.219 0.734 0.833 0.939 0.758 CB 1.455 34 residues pruned to eliminate duplicates Z: 43 38.206 2.210 0.466 0.690 1.000 0.667 CB 1.530 43 residues pruned to eliminate duplicates Z: 37 35.758 2.190 0.660 0.737 0.917 0.639 CB 1.445 37 residues pruned to eliminate duplicates Z: 35 41.032 2.214 0.739 0.808 0.971 0.647 CB 1.440 35 residues pruned to eliminate duplicates Z: 35 35.929 2.192 0.516 0.836 0.971 0.706 CB 1.430 35 residues pruned to eliminate duplicates Z: 59 36.839 2.166 0.528 0.580 0.931 0.552 CB 1.453 59 residues pruned to eliminate duplicates Z: 80 38.084 2.142 0.543 0.580 0.886 0.544 CB 1.355 80 residues pruned to eliminate duplicates Z: 78 49.006 2.206 0.617 0.626 0.961 0.623 CB 1.447 78 residues pruned to eliminate duplicates Z: 123 55.158 2.179 0.630 0.612 0.910 0.656 CB 1.389 123 residues pruned to eliminate duplicates Z: 72 46.458 2.149 0.698 0.671 0.944 0.648 CB 1.368 72 residues pruned to eliminate duplicates Z: 51 30.011 2.109 0.648 0.579 0.880 0.560 CB 1.286 51 residues pruned to eliminate duplicates Z: 45 36.616 2.159 0.593 0.707 0.955 0.682 CB 1.394 45 residues pruned to eliminate duplicates Z: 105 55.847 2.179 0.704 0.649 0.923 0.654 CB 1.391 105 residues pruned to eliminate duplicates Z: 47 38.126 2.174 0.607 0.699 0.935 0.587 CB 1.436 47 residues pruned to eliminate duplicates Z: 44 32.079 2.112 0.577 0.604 0.930 0.581 CB 1.429 44 residues pruned to eliminate duplicates Z: 131 65.304 2.226 0.729 0.592 0.931 0.631 CB 1.463 131 residues pruned to eliminate duplicates Z: 72 42.662 2.136 0.643 0.649 0.930 0.676 CB 1.350 72 residues pruned to eliminate duplicates Z: 124 58.072 2.189 0.612 0.612 0.911 0.634 CB 1.466 124 residues pruned to eliminate duplicates Z: 68 33.384 2.065 0.625 0.545 0.851 0.687 CB 1.367 68 residues pruned to eliminate duplicates Z: 105 52.401 2.141 0.646 0.653 0.904 0.692 CB 1.399 105 residues pruned to eliminate duplicates Z: 89 41.708 2.116 0.581 0.580 0.886 0.591 CB 1.388 89 residues pruned to eliminate duplicates Z: 65 35.119 2.078 0.608 0.611 0.891 0.703 CB 1.328 65 residues pruned to eliminate duplicates Z: 105 54.837 2.176 0.719 0.651 0.904 0.692 CB 1.382 105 residues pruned to eliminate duplicates Z: 116 53.155 2.171 0.573 0.596 0.930 0.661 CB 1.422 116 residues pruned to eliminate duplicates Z: 58 42.165 2.190 0.807 0.644 0.912 0.719 CB 1.352 58 residues pruned to eliminate duplicates Z: 25 26.934 2.200 0.674 0.647 0.917 0.708 CB 1.420 25 residues pruned to eliminate duplicates Z: 91 44.452 2.142 0.633 0.587 0.900 0.656 CB 1.369 91 residues pruned to eliminate duplicates Z: 57 40.900 2.168 0.739 0.657 0.929 0.625 CB 1.349 57 residues pruned to eliminate duplicates Z: 61 38.982 2.194 0.670 0.631 0.883 0.700 CB 1.375 61 residues pruned to eliminate duplicates Z: 44 30.179 2.202 0.763 0.535 0.837 0.558 CB 1.368 44 residues pruned to eliminate duplicates Z: 59 41.803 2.214 0.720 0.623 0.897 0.759 CB 1.432 59 residues pruned to eliminate duplicates Z: 88 51.102 2.168 0.670 0.655 0.931 0.701 CB 1.407 88 residues pruned to eliminate duplicates Z: 69 45.695 2.177 0.645 0.684 0.926 0.647 CB 1.411 69 residues pruned to eliminate duplicates Z: 58 35.035 2.176 0.549 0.603 0.895 0.684 CB 1.395 58 residues pruned to eliminate duplicates Z: 45 25.394 2.098 0.643 0.505 0.864 0.545 CB 1.279 45 residues pruned to eliminate duplicates Z: 21 20.713 2.029 0.655 0.620 0.900 0.600 CB 1.368 21 residues pruned to eliminate duplicates Z: 39 25.760 2.075 0.700 0.489 0.868 0.605 CB 1.378 39 residues pruned to eliminate duplicates Z: 26 25.268 2.131 0.560 0.627 0.920 0.600 CB 1.466 26 residues pruned to eliminate duplicates Z: 13 5.203 1.780 0.436 0.267 0.667 0.500 CB 1.150 13 residues pruned to eliminate duplicates Z: 38 32.806 2.164 0.821 0.621 0.892 0.676 CB 1.369 38 residues pruned to eliminate duplicates Z: 40 34.326 2.156 0.894 0.612 0.846 0.641 CB 1.430 40 residues pruned to eliminate duplicates Z: 38 36.802 2.207 0.870 0.651 0.919 0.730 CB 1.387 38 residues pruned to eliminate duplicates Z: 54 41.276 2.168 0.809 0.638 0.887 0.604 CB 1.432 54 residues pruned to eliminate duplicates Z: 40 30.946 2.119 0.723 0.604 0.872 0.615 CB 1.410 40 residues pruned to eliminate duplicates Z: 36 33.900 2.155 0.864 0.637 0.886 0.743 CB 1.416 36 residues pruned to eliminate duplicates Z: 41 25.944 2.124 0.569 0.587 0.850 0.600 CB 1.332 41 residues pruned to eliminate duplicates Z: 58 41.751 2.190 0.804 0.642 0.912 0.544 CB 1.344 58 residues pruned to eliminate duplicates Z: 36 33.616 2.189 0.892 0.636 0.886 0.743 CB 1.364 36 residues pruned to eliminate duplicates Z: 36 30.941 2.171 0.724 0.636 0.914 0.714 CB 1.345 36 residues pruned to eliminate duplicates Z: 58 45.306 2.255 0.732 0.620 0.895 0.684 CB 1.534 58 residues pruned to eliminate duplicates Z: 39 30.606 2.169 0.760 0.622 0.842 0.737 CB 1.377 39 residues pruned to eliminate duplicates Z: 41 32.069 2.140 0.866 0.596 0.875 0.675 CB 1.324 41 residues pruned to eliminate duplicates Z: 38 38.508 2.175 0.996 0.662 0.892 0.730 CB 1.407 38 residues pruned to eliminate duplicates Z: 39 34.546 2.130 0.879 0.620 0.895 0.711 CB 1.397 39 residues pruned to eliminate duplicates Z: 104 56.417 2.159 0.756 0.662 0.922 0.689 CB 1.367 104 residues pruned to eliminate duplicates Z: 40 36.040 2.160 1.005 0.622 0.923 0.692 CB 1.287 40 residues pruned to eliminate duplicates Z: 22 29.112 2.124 0.877 0.735 0.952 0.714 CB 1.355 22 residues pruned to eliminate duplicates Z: 68 51.310 2.290 0.889 0.555 0.910 0.642 CB 1.509 68 residues pruned to eliminate duplicates Z: 22 28.834 2.138 0.937 0.742 0.905 0.762 CB 1.353 22 residues pruned to eliminate duplicates Z: 37 43.009 2.233 1.117 0.672 0.917 0.639 CB 1.411 37 residues pruned to eliminate duplicates Z: 29 24.567 1.993 0.917 0.556 0.786 0.571 CB 1.465 29 residues pruned to eliminate duplicates Z: 37 34.836 2.213 0.945 0.654 0.889 0.667 CB 1.315 37 residues pruned to eliminate duplicates Z: 40 34.037 2.126 1.053 0.601 0.923 0.513 CB 1.228 40 residues pruned to eliminate duplicates Z: 38 38.128 2.180 1.205 0.661 0.865 0.568 CB 1.299 38 residues pruned to eliminate duplicates Z: 36 33.418 2.170 1.082 0.622 0.886 0.514 CB 1.258 36 residues pruned to eliminate duplicates Z: 26 21.856 1.975 0.975 0.604 0.840 0.520 CB 1.209 26 residues pruned to eliminate duplicates Z: 21 21.011 1.929 0.895 0.754 0.850 0.650 CB 1.205 21 residues pruned to eliminate duplicates Z: 55 33.320 2.102 0.943 0.525 0.833 0.352 CB 1.299 55 residues pruned to eliminate duplicates Z: 39 30.933 2.153 1.042 0.636 0.868 0.368 CB 1.158 39 residues pruned to eliminate duplicates Z: 14 7.324 1.881 0.731 0.332 0.769 0.154 CB 0.974 14 residues pruned to eliminate duplicates Z: 20 17.917 1.912 1.010 0.660 0.895 0.211 CB 1.031 20 residues pruned to eliminate duplicates Z: 39 38.275 2.285 0.816 0.617 0.868 0.447 CB 1.543 39 residues pruned to eliminate duplicates Z: 34 30.719 2.346 0.654 0.434 0.939 0.606 CB 1.571 34 residues pruned to eliminate duplicates Z: 30 24.865 2.244 0.492 0.495 0.897 0.517 CB 1.545 30 residues pruned to eliminate duplicates Z: 60 44.499 2.112 0.932 0.617 0.881 0.627 CB 1.442 60 residues pruned to eliminate duplicates Z: 67 50.084 2.289 0.844 0.585 0.894 0.561 CB 1.506 67 residues pruned to eliminate duplicates Z: 20 36.075 2.447 0.799 0.643 0.895 0.632 CB 1.838 20 residues pruned to eliminate duplicates Z: 64 56.313 2.344 0.754 0.568 0.921 0.635 CB 1.755 64 residues pruned to eliminate duplicates Z: 31 32.213 2.347 0.608 0.491 0.900 0.500 CB 1.748 31 residues pruned to eliminate duplicates Z: 30 31.634 2.366 0.694 0.451 0.897 0.448 CB 1.718 30 residues pruned to eliminate duplicates Z: 39 26.484 2.276 0.688 0.427 0.763 0.474 CB 1.580 39 residues pruned to eliminate duplicates Z: 19 28.753 2.457 0.791 0.492 0.944 0.500 CA 1.643 19 residues pruned to eliminate duplicates Z: 19 32.539 2.450 0.718 0.599 0.944 0.389 CA 1.755 19 residues pruned to eliminate duplicates Z: 24 29.767 2.336 0.874 0.489 0.870 0.478 CB 1.648 24 residues pruned to eliminate duplicates Z: 28 26.465 2.262 0.725 0.458 0.889 0.593 CB 1.533 28 residues pruned to eliminate duplicates Z: 21 26.311 2.376 0.769 0.534 0.750 0.500 CA 1.805 21 residues pruned to eliminate duplicates Z: 26 40.730 2.472 0.957 0.470 0.920 0.600 CA 1.887 26 residues pruned to eliminate duplicates Z: 18 39.712 2.471 0.983 0.566 1.000 0.471 CB 1.845 18 residues pruned to eliminate duplicates Z: 24 26.412 2.455 0.665 0.518 0.783 0.478 CB 1.691 24 residues pruned to eliminate duplicates Z: 66 48.460 2.235 0.854 0.559 0.923 0.585 CB 1.483 66 residues pruned to eliminate duplicates Z: 28 31.157 2.384 0.670 0.474 0.889 0.593 CB 1.740 28 residues pruned to eliminate duplicates Z: 85 64.503 2.293 0.863 0.612 0.929 0.571 CB 1.595 86 residues pruned to eliminate duplicates Z: 10 31.513 2.275 1.001 0.809 1.000 0.778 CA 1.763 10 residues pruned to eliminate duplicates Z: 28 34.635 2.402 0.790 0.449 0.889 0.481 CB 1.837 28 residues pruned to eliminate duplicates Z: 29 37.971 2.407 0.780 0.469 0.929 0.464 CB 1.862 29 residues pruned to eliminate duplicates Z: 56 48.140 2.210 0.817 0.610 0.909 0.582 CB 1.602 56 residues pruned to eliminate duplicates Z: 9 14.019 2.449 0.634 0.326 0.875 0.500 CA 1.713 9 residues pruned to eliminate duplicates Z: 71 51.892 2.234 0.914 0.614 0.914 0.557 CB 1.425 71 residues pruned to eliminate duplicates Z: 30 35.791 2.322 0.806 0.524 0.897 0.586 CB 1.725 30 residues pruned to eliminate duplicates Z: 29 39.909 2.401 0.776 0.528 0.964 0.714 CB 1.785 29 residues pruned to eliminate duplicates Z: 30 31.515 2.364 0.690 0.441 0.862 0.552 CB 1.807 30 residues pruned to eliminate duplicates Z: 71 51.991 2.360 0.702 0.549 0.871 0.571 CB 1.693 71 residues pruned to eliminate duplicates Z: 36 40.475 2.324 0.726 0.616 0.914 0.743 CB 1.672 36 residues pruned to eliminate duplicates Z: 28 29.448 2.255 0.718 0.572 0.852 0.704 CA 1.601 28 residues pruned to eliminate duplicates Z: 26 27.375 2.272 0.631 0.654 0.800 0.680 CA 1.600 26 residues pruned to eliminate duplicates Z: 32 30.495 2.271 0.670 0.540 0.871 0.677 CB 1.594 32 residues pruned to eliminate duplicates Z: 35 41.149 2.336 0.663 0.652 0.941 0.706 CB 1.675 35 residues pruned to eliminate duplicates Z: 37 34.651 2.287 0.639 0.574 0.889 0.694 CB 1.615 37 residues pruned to eliminate duplicates Z: 36 39.398 2.339 0.689 0.626 0.886 0.771 CB 1.689 36 residues pruned to eliminate duplicates Z: 35 42.345 2.369 0.773 0.643 0.882 0.735 CB 1.713 35 residues pruned to eliminate duplicates Z: 27 43.361 2.435 0.734 0.679 0.962 0.692 CB 1.777 27 residues pruned to eliminate duplicates Z: 28 41.573 2.391 0.700 0.658 0.926 0.667 CA 1.837 28 residues pruned to eliminate duplicates Z: 34 36.647 2.306 0.554 0.632 0.939 0.636 CB 1.675 34 residues pruned to eliminate duplicates Z: 27 47.791 2.451 0.785 0.703 1.000 0.769 CB 1.780 27 residues pruned to eliminate duplicates Z: 29 37.740 2.350 0.729 0.631 0.929 0.679 CB 1.672 29 residues pruned to eliminate duplicates Z: 35 42.146 2.358 0.703 0.628 0.912 0.706 CB 1.750 36 residues pruned to eliminate duplicates Z: 16 40.827 2.438 0.979 0.924 0.933 0.867 CB 1.644 16 residues pruned to eliminate duplicates Z: 36 37.929 2.293 0.648 0.612 0.914 0.657 CB 1.669 36 residues pruned to eliminate duplicates Z: 36 37.233 2.319 0.650 0.615 0.886 0.714 CB 1.665 36 residues pruned to eliminate duplicates Z: 25 44.892 2.437 0.895 0.661 0.958 0.667 CB 1.783 25 residues pruned to eliminate duplicates Z: 32 40.565 2.375 0.753 0.592 0.903 0.677 CB 1.774 32 residues pruned to eliminate duplicates Z: 34 32.075 2.232 0.685 0.530 0.848 0.576 CB 1.700 34 residues pruned to eliminate duplicates Z: 32 39.587 2.370 0.734 0.586 0.903 0.677 CB 1.763 32 residues pruned to eliminate duplicates Z: 31 41.177 2.325 0.761 0.607 0.933 0.700 CA 1.777 31 residues pruned to eliminate duplicates Z: 32 38.151 2.356 0.704 0.583 0.903 0.613 CB 1.745 32 residues pruned to eliminate duplicates Z: 25 46.725 2.443 0.868 0.675 1.000 0.750 CB 1.779 25 residues pruned to eliminate duplicates Z: 63 57.938 2.354 0.774 0.600 0.968 0.694 CB 1.655 63 residues pruned to eliminate duplicates Z: 13 21.624 2.383 0.540 0.447 1.000 0.583 CA 1.797 13 residues pruned to eliminate duplicates Z: 29 41.144 2.382 0.818 0.624 0.929 0.714 CB 1.721 29 residues pruned to eliminate duplicates Z: 32 37.875 2.339 0.634 0.594 0.903 0.613 CB 1.801 32 residues pruned to eliminate duplicates Z: 38 38.417 2.302 0.712 0.574 0.892 0.676 CB 1.674 38 residues pruned to eliminate duplicates Z: 35 32.507 2.219 0.655 0.527 0.853 0.706 CB 1.733 35 residues pruned to eliminate duplicates Z: 38 38.084 2.261 0.773 0.563 0.892 0.649 CB 1.647 38 residues pruned to eliminate duplicates Z: 35 39.264 2.362 0.631 0.606 0.941 0.647 CB 1.679 35 residues pruned to eliminate duplicates Z: 22 26.417 2.231 0.903 0.449 0.857 0.476 CB 1.670 22 residues pruned to eliminate duplicates Z: 37 36.575 2.257 0.767 0.575 0.889 0.667 CB 1.601 37 residues pruned to eliminate duplicates Z: 6 2.291 1.833 0.687 0.459 0.800 0.800 CB 0.432 Z: 13 15.871 2.081 0.755 0.464 1.000 0.583 CB 1.302 20 residues pruned to eliminate duplicates Z: 13 16.339 2.078 0.789 0.463 1.000 0.667 CB 1.317 13 residues pruned to eliminate duplicates Z: 15 13.004 1.906 0.695 0.396 0.929 0.571 CB 1.293 15 residues pruned to eliminate duplicates Z: 14 15.955 1.991 0.819 0.440 1.000 0.615 CB 1.299 14 residues pruned to eliminate duplicates Z: 14 15.346 2.000 0.712 0.451 1.000 0.615 CB 1.308 14 residues pruned to eliminate duplicates Z: 15 13.666 1.908 0.728 0.460 1.000 0.500 CB 1.153 15 residues pruned to eliminate duplicates Z: 14 12.129 1.877 0.369 0.524 1.000 0.615 CB 1.278 14 residues pruned to eliminate duplicates Z: 14 13.479 1.911 0.579 0.490 1.000 0.615 CB 1.252 14 residues pruned to eliminate duplicates Z: 11 19.904 2.078 0.798 0.669 1.000 0.600 CB 1.440 11 residues pruned to eliminate duplicates Z: 13 8.440 1.820 0.432 0.491 1.000 0.500 CB 0.943 13 residues pruned to eliminate duplicates Z: 7 9.126 1.806 1.099 0.268 0.833 0.167 CB 1.536 7 residues pruned to eliminate duplicates Z: 34 28.592 2.163 0.767 0.415 0.939 0.576 CB 1.515 34 residues pruned to eliminate duplicates Z: 25 40.190 2.492 0.910 0.474 0.917 0.542 CA 1.931 25 residues pruned to eliminate duplicates Z: 8 12.869 2.099 0.714 0.691 0.857 0.714 CB 1.325 8 residues pruned to eliminate duplicates Z: 27 29.801 2.325 0.852 0.419 0.846 0.385 CB 1.746 27 residues pruned to eliminate duplicates Z: 23 22.159 2.214 0.597 0.414 0.909 0.318 CB 1.607 23 residues pruned to eliminate duplicates Z: 9 13.689 2.023 0.740 0.612 0.750 0.500 CB 1.648 9 residues pruned to eliminate duplicates Z: 58 38.986 2.152 0.685 0.524 0.912 0.526 CB 1.524 58 residues pruned to eliminate duplicates Z: 20 27.836 2.340 0.885 0.423 0.947 0.526 CB 1.656 20 residues pruned to eliminate duplicates Z: 19 35.082 2.377 1.053 0.486 0.944 0.611 CB 1.819 19 residues pruned to eliminate duplicates Z: 18 30.830 2.360 0.991 0.388 0.941 0.471 CB 1.905 18 residues pruned to eliminate duplicates Z: 26 38.450 2.443 1.001 0.460 0.920 0.400 CB 1.781 26 residues pruned to eliminate duplicates Z: 27 33.489 2.347 0.912 0.465 0.885 0.423 CB 1.714 27 residues pruned to eliminate duplicates Z: 26 35.146 2.430 0.856 0.450 0.920 0.520 CB 1.782 26 residues pruned to eliminate duplicates Z: 26 30.638 2.450 0.961 0.370 0.800 0.480 CB 1.834 26 residues pruned to eliminate duplicates Z: 44 37.184 2.334 0.795 0.452 0.884 0.442 CB 1.609 44 residues pruned to eliminate duplicates Z: 45 30.638 2.230 0.766 0.439 0.864 0.500 CB 1.446 45 residues pruned to eliminate duplicates Z: 19 32.167 2.411 0.995 0.467 0.889 0.611 CB 1.834 19 residues pruned to eliminate duplicates Z: 23 35.441 2.406 0.953 0.418 0.955 0.545 CB 1.835 23 residues pruned to eliminate duplicates Z: 21 23.619 2.429 0.559 0.399 0.900 0.450 CB 1.725 21 residues pruned to eliminate duplicates Z: 29 33.501 2.415 0.947 0.437 0.857 0.393 CB 1.678 29 residues pruned to eliminate duplicates Z: 26 35.417 2.449 0.968 0.444 0.880 0.480 CB 1.769 26 residues pruned to eliminate duplicates Z: 11 7.561 2.031 0.812 0.327 0.700 0.300 CB 1.123 11 residues pruned to eliminate duplicates Z: 17 16.388 2.148 0.898 0.335 0.875 0.375 CB 1.375 17 residues pruned to eliminate duplicates Z: 9 11.515 2.002 0.850 0.347 0.750 0.375 CB 1.731 9 residues pruned to eliminate duplicates Z: 27 28.942 2.302 0.877 0.397 0.846 0.538 CB 1.730 27 residues pruned to eliminate duplicates Z: 14 9.502 2.090 0.618 0.336 0.769 0.231 CB 1.211 14 residues pruned to eliminate duplicates Z: 134 73.566 2.296 0.761 0.569 0.932 0.617 CB 1.584 193 residues pruned to eliminate duplicates Z: 22 43.638 2.389 0.889 0.797 0.952 0.714 CB 1.709 22 residues pruned to eliminate duplicates Z: 32 37.064 2.316 0.903 0.548 0.935 0.516 CB 1.541 32 residues pruned to eliminate duplicates Z: 80 57.211 2.352 0.733 0.606 0.899 0.696 CB 1.590 80 residues pruned to eliminate duplicates Z: 29 43.223 2.347 0.881 0.648 0.964 0.571 CB 1.671 29 residues pruned to eliminate duplicates Z: 82 56.456 2.347 0.674 0.609 0.914 0.642 CB 1.576 82 residues pruned to eliminate duplicates Z: 31 41.079 2.357 0.868 0.576 0.933 0.600 CB 1.696 31 residues pruned to eliminate duplicates Z: 21 44.904 2.290 1.055 0.789 0.950 0.750 CA 1.742 21 residues pruned to eliminate duplicates Z: 41 35.744 2.193 0.818 0.501 0.875 0.500 CB 1.618 41 residues pruned to eliminate duplicates Z: 31 41.767 2.355 0.815 0.592 0.967 0.500 CB 1.691 31 residues pruned to eliminate duplicates Z: 21 47.829 2.437 0.956 0.819 0.950 0.750 CB 1.791 21 residues pruned to eliminate duplicates Z: 29 45.119 2.363 0.837 0.642 0.964 0.714 CB 1.783 29 residues pruned to eliminate duplicates Z: 21 44.717 2.450 0.945 0.828 0.900 0.700 CB 1.755 21 residues pruned to eliminate duplicates Z: 32 37.067 2.363 0.657 0.622 0.968 0.677 CB 1.566 32 residues pruned to eliminate duplicates Z: 36 36.195 2.318 0.697 0.535 0.914 0.657 CB 1.643 36 residues pruned to eliminate duplicates Z: 31 39.862 2.331 0.744 0.593 0.967 0.667 CB 1.694 31 residues pruned to eliminate duplicates Z: 34 37.244 2.258 0.725 0.541 0.970 0.606 CB 1.648 34 residues pruned to eliminate duplicates Z: 29 35.905 2.353 0.592 0.580 0.964 0.750 CB 1.740 29 residues pruned to eliminate duplicates Z: 80 53.643 2.345 0.627 0.611 0.899 0.696 CB 1.585 80 residues pruned to eliminate duplicates Z: 55 51.771 2.357 0.688 0.629 0.981 0.667 CB 1.598 55 residues pruned to eliminate duplicates Z: 78 57.840 2.363 0.637 0.624 0.948 0.610 CB 1.599 78 residues pruned to eliminate duplicates Z: 55 47.994 2.348 0.695 0.612 0.963 0.667 CB 1.532 55 residues pruned to eliminate duplicates Z: 57 48.475 2.334 0.795 0.570 0.911 0.625 CB 1.586 57 residues pruned to eliminate duplicates Z: 80 62.092 2.350 0.711 0.621 0.962 0.620 CB 1.611 80 residues pruned to eliminate duplicates Z: 31 37.263 2.334 0.797 0.633 0.967 0.567 CB 1.481 31 residues pruned to eliminate duplicates Z: 80 59.204 2.336 0.680 0.603 0.962 0.608 CB 1.600 80 residues pruned to eliminate duplicates Z: 31 29.968 2.266 0.692 0.558 0.933 0.633 CB 1.446 31 residues pruned to eliminate duplicates Z: 89 51.719 2.229 0.686 0.597 0.898 0.636 CB 1.490 89 residues pruned to eliminate duplicates Z: 113 65.764 2.293 0.764 0.607 0.893 0.679 CB 1.555 113 residues pruned to eliminate duplicates Z: 34 35.735 2.301 0.710 0.618 0.970 0.636 CB 1.458 34 residues pruned to eliminate duplicates Z: 66 49.282 2.309 0.749 0.565 0.923 0.600 CB 1.540 66 residues pruned to eliminate duplicates Z: 71 63.781 2.378 0.745 0.693 0.957 0.714 CB 1.609 71 residues pruned to eliminate duplicates Z: 115 65.855 2.284 0.629 0.612 0.947 0.684 CB 1.573 115 residues pruned to eliminate duplicates Z: 67 45.849 2.274 0.689 0.561 0.924 0.576 CB 1.499 67 residues pruned to eliminate duplicates Z: 57 54.045 2.348 0.790 0.625 0.964 0.679 CB 1.583 57 residues pruned to eliminate duplicates Z: 31 33.758 2.339 0.687 0.656 0.933 0.633 CB 1.449 31 residues pruned to eliminate duplicates Z: 58 46.661 2.345 0.613 0.611 0.947 0.614 CB 1.552 58 residues pruned to eliminate duplicates Z: 83 58.397 2.350 0.706 0.611 0.927 0.695 CB 1.562 83 residues pruned to eliminate duplicates Z: 81 63.430 2.348 0.799 0.606 0.950 0.613 CB 1.597 81 residues pruned to eliminate duplicates Z: 142 79.677 2.317 0.787 0.595 0.936 0.631 CB 1.581 142 residues pruned to eliminate duplicates Z: 93 55.476 2.292 0.696 0.607 0.924 0.674 CB 1.455 93 residues pruned to eliminate duplicates Z: 81 57.040 2.337 0.811 0.529 0.913 0.650 CB 1.605 81 residues pruned to eliminate duplicates Z: 72 60.435 2.379 0.673 0.682 0.944 0.761 CB 1.616 72 residues pruned to eliminate duplicates Z: 56 45.580 2.316 0.642 0.614 0.964 0.673 CB 1.506 56 residues pruned to eliminate duplicates Z: 58 50.393 2.358 0.651 0.598 0.965 0.596 CB 1.618 58 residues pruned to eliminate duplicates Z: 74 63.617 2.379 0.750 0.660 0.973 0.685 CB 1.586 74 residues pruned to eliminate duplicates Z: 56 48.021 2.340 0.641 0.620 0.964 0.709 CB 1.563 56 residues pruned to eliminate duplicates Z: 39 37.029 2.287 0.776 0.525 0.921 0.579 CB 1.567 39 residues pruned to eliminate duplicates Z: 24 39.880 2.393 0.789 0.676 0.957 0.696 CB 1.727 24 residues pruned to eliminate duplicates Z: 105 73.599 2.300 0.800 0.663 0.942 0.683 CB 1.590 105 residues pruned to eliminate duplicates Z: 79 58.225 2.347 0.747 0.600 0.923 0.615 CB 1.583 79 residues pruned to eliminate duplicates Z: 27 29.782 2.285 0.596 0.635 0.885 0.731 CB 1.595 27 residues pruned to eliminate duplicates Z: 115 63.483 2.277 0.758 0.567 0.921 0.658 CB 1.512 115 residues pruned to eliminate duplicates Z: 106 69.515 2.289 0.825 0.632 0.924 0.667 CB 1.553 106 residues pruned to eliminate duplicates Z: 25 33.459 2.371 0.739 0.648 0.875 0.750 CB 1.649 25 residues pruned to eliminate duplicates Z: 53 52.666 2.278 0.757 0.659 0.942 0.731 CB 1.671 53 residues pruned to eliminate duplicates Z: 73 54.787 2.345 0.695 0.658 0.917 0.694 CB 1.529 73 residues pruned to eliminate duplicates Z: 105 63.089 2.261 0.752 0.636 0.913 0.644 CB 1.505 105 residues pruned to eliminate duplicates Z: 25 37.353 2.385 0.794 0.665 0.917 0.708 CB 1.669 25 residues pruned to eliminate duplicates Z: 39 45.863 2.248 0.974 0.613 0.921 0.684 CB 1.636 39 residues pruned to eliminate duplicates Z: 25 37.371 2.350 0.902 0.658 0.917 0.708 CB 1.608 25 residues pruned to eliminate duplicates Z: 93 66.436 2.345 0.851 0.596 0.913 0.652 CB 1.595 93 residues pruned to eliminate duplicates Z: 113 75.883 2.260 0.861 0.638 0.955 0.679 CB 1.568 113 residues pruned to eliminate duplicates Z: 80 60.248 2.329 0.789 0.616 0.937 0.658 CB 1.557 80 residues pruned to eliminate duplicates Z: 31 30.154 2.184 0.803 0.548 0.867 0.600 CB 1.540 31 residues pruned to eliminate duplicates Z: 82 61.981 2.323 0.779 0.606 0.963 0.667 CB 1.564 82 residues pruned to eliminate duplicates Z: 58 52.434 2.246 0.891 0.630 0.930 0.684 CB 1.556 58 residues pruned to eliminate duplicates Z: 116 72.221 2.290 0.779 0.608 0.939 0.635 CB 1.589 116 residues pruned to eliminate duplicates Z: 28 26.329 2.145 0.815 0.579 0.889 0.630 CB 1.357 28 residues pruned to eliminate duplicates Z: 54 52.402 2.345 0.873 0.631 0.962 0.623 CB 1.505 54 residues pruned to eliminate duplicates Z: 58 49.477 2.223 0.873 0.633 0.895 0.579 CB 1.553 58 residues pruned to eliminate duplicates Z: 59 48.530 2.220 0.924 0.614 0.879 0.638 CB 1.522 59 residues pruned to eliminate duplicates Z: 43 31.149 2.088 0.716 0.556 0.905 0.571 CB 1.405 43 residues pruned to eliminate duplicates Z: 107 73.876 2.277 0.874 0.661 0.934 0.708 CB 1.551 107 residues pruned to eliminate duplicates Z: 39 31.258 2.123 0.725 0.572 0.868 0.579 CB 1.487 39 residues pruned to eliminate duplicates Z: 17 19.985 2.136 0.969 0.497 0.812 0.688 CB 1.468 17 residues pruned to eliminate duplicates Z: 56 39.077 2.107 0.793 0.563 0.873 0.582 CB 1.503 56 residues pruned to eliminate duplicates Z: 19 24.023 2.113 0.976 0.462 0.889 0.611 CB 1.586 19 residues pruned to eliminate duplicates Z: 60 44.514 2.248 0.882 0.571 0.864 0.525 CB 1.480 60 residues pruned to eliminate duplicates Z: 38 34.563 2.112 0.849 0.644 0.892 0.730 CB 1.426 38 residues pruned to eliminate duplicates Z: 40 36.571 2.109 0.839 0.621 0.897 0.718 CB 1.500 40 residues pruned to eliminate duplicates Z: 36 33.602 2.096 0.863 0.595 0.886 0.657 CB 1.500 36 residues pruned to eliminate duplicates Z: 41 33.169 2.090 0.898 0.585 0.850 0.625 CB 1.433 41 residues pruned to eliminate duplicates Z: 62 45.820 2.197 0.799 0.589 0.902 0.639 CB 1.512 62 residues pruned to eliminate duplicates Z: 33 27.211 2.038 0.724 0.577 0.844 0.656 CB 1.507 33 residues pruned to eliminate duplicates Z: 42 28.922 2.064 0.611 0.549 0.878 0.537 CB 1.475 42 residues pruned to eliminate duplicates Z: 23 20.256 1.967 0.624 0.628 0.909 0.591 CB 1.318 23 residues pruned to eliminate duplicates Z: 43 31.732 2.035 0.892 0.595 0.857 0.643 CB 1.355 43 residues pruned to eliminate duplicates Z: 37 37.371 2.139 0.858 0.639 0.944 0.639 CB 1.456 37 residues pruned to eliminate duplicates Z: 104 66.313 2.229 0.864 0.623 0.913 0.641 CB 1.534 104 residues pruned to eliminate duplicates Z: 22 26.972 2.001 0.687 0.768 0.952 0.667 CB 1.444 22 residues pruned to eliminate duplicates Z: 29 24.202 2.009 0.695 0.588 0.857 0.607 CB 1.441 29 residues pruned to eliminate duplicates Z: 119 75.997 2.282 0.846 0.627 0.941 0.695 CB 1.566 119 residues pruned to eliminate duplicates Z: 57 47.716 2.236 0.922 0.590 0.857 0.607 CB 1.588 57 residues pruned to eliminate duplicates Z: 26 21.714 1.917 0.636 0.646 0.880 0.600 CB 1.372 26 residues pruned to eliminate duplicates Z: 60 54.071 2.200 1.084 0.633 0.864 0.593 CB 1.568 60 residues pruned to eliminate duplicates Z: 32 37.878 2.181 0.898 0.631 0.935 0.742 CB 1.554 32 residues pruned to eliminate duplicates Z: 23 30.401 2.035 1.071 0.696 0.909 0.545 CB 1.414 23 residues pruned to eliminate duplicates Z: 85 52.977 2.180 0.871 0.600 0.905 0.607 CB 1.424 85 residues pruned to eliminate duplicates Z: 22 33.316 2.054 0.990 0.761 1.000 0.571 CB 1.410 22 residues pruned to eliminate duplicates Z: 29 28.790 2.071 0.765 0.582 0.893 0.643 CB 1.540 29 residues pruned to eliminate duplicates Z: 43 33.614 2.026 0.881 0.567 0.905 0.548 CB 1.409 43 residues pruned to eliminate duplicates Z: 70 53.461 2.225 0.990 0.563 0.884 0.580 CB 1.546 70 residues pruned to eliminate duplicates Z: 67 56.271 2.272 0.894 0.602 0.924 0.652 CB 1.580 71 residues pruned to eliminate duplicates Z: 6 6.333 1.594 0.648 0.532 0.800 0.400 N 1.306 6 residues pruned to eliminate duplicates Z: 26 36.199 2.347 0.816 0.558 0.920 0.440 CB 1.745 26 residues pruned to eliminate duplicates Z: 35 34.544 2.325 0.802 0.445 0.912 0.588 CB 1.642 35 residues pruned to eliminate duplicates Z: 27 32.314 2.272 0.859 0.545 0.885 0.462 CB 1.624 27 residues pruned to eliminate duplicates Z: 33 32.909 2.405 0.823 0.425 0.875 0.500 CB 1.641 33 residues pruned to eliminate duplicates Z: 25 29.001 2.354 0.820 0.474 0.833 0.500 CB 1.702 25 residues pruned to eliminate duplicates Z: 50 50.944 2.256 0.910 0.664 0.959 0.694 CB 1.514 50 residues pruned to eliminate duplicates Z: 66 60.456 2.307 0.973 0.602 0.938 0.615 CB 1.592 66 residues pruned to eliminate duplicates Z: 25 36.439 2.480 0.815 0.519 0.917 0.542 CB 1.770 25 residues pruned to eliminate duplicates Z: 30 39.044 2.467 0.788 0.519 0.897 0.552 CB 1.800 30 residues pruned to eliminate duplicates Z: 57 60.691 2.433 0.852 0.558 0.946 0.643 CB 1.797 61 residues pruned to eliminate duplicates Z: 15 33.916 2.376 0.947 0.755 0.929 0.500 CB 1.681 15 residues pruned to eliminate duplicates Z: 31 38.092 2.457 0.844 0.484 0.900 0.533 CB 1.734 31 residues pruned to eliminate duplicates Z: 32 35.881 2.395 0.874 0.506 0.871 0.613 CB 1.639 32 residues pruned to eliminate duplicates Z: 31 45.152 2.464 0.970 0.558 0.967 0.633 CB 1.661 31 residues pruned to eliminate duplicates Z: 36 35.632 2.316 0.756 0.537 0.914 0.629 CB 1.562 36 residues pruned to eliminate duplicates Z: 69 57.291 2.238 0.903 0.595 0.941 0.676 CB 1.583 69 residues pruned to eliminate duplicates Z: 30 44.724 2.461 1.046 0.501 0.966 0.552 CB 1.707 30 residues pruned to eliminate duplicates Z: 31 41.904 2.406 0.901 0.489 0.967 0.633 CB 1.750 31 residues pruned to eliminate duplicates Z: 49 48.301 2.224 0.942 0.618 0.938 0.646 CB 1.540 49 residues pruned to eliminate duplicates Z: 67 53.074 2.274 0.897 0.579 0.894 0.667 CB 1.570 67 residues pruned to eliminate duplicates Z: 30 36.091 2.420 0.856 0.510 0.862 0.621 CB 1.714 30 residues pruned to eliminate duplicates Z: 48 54.071 2.406 0.880 0.618 0.915 0.723 CB 1.705 48 residues pruned to eliminate duplicates Z: 56 52.633 2.246 0.972 0.605 0.945 0.636 CB 1.534 56 residues pruned to eliminate duplicates Z: 30 40.825 2.439 0.869 0.523 0.966 0.621 CB 1.683 30 residues pruned to eliminate duplicates Z: 133 81.905 2.282 0.894 0.646 0.917 0.682 CB 1.571 133 residues pruned to eliminate duplicates Z: 90 63.163 2.266 0.950 0.587 0.899 0.652 CB 1.551 90 residues pruned to eliminate duplicates 674 residues left after pruning, divided into chains as follows: A: 27 B: 9 C: 6 D: 18 E: 14 F: 16 G: 22 H: 16 I: 36 J: 96 K: 184 L: 6 M: 224 CC for partial structure against native data = 38.67 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 0.492, Connect. = 0.754 for dens.mod. cycle 1 = 0.300, Contrast = 0.566, Connect. = 0.779 for dens.mod. cycle 2 = 0.300, Contrast = 0.678, Connect. = 0.807 for dens.mod. cycle 3 = 0.300, Contrast = 0.691, Connect. = 0.810 for dens.mod. cycle 4 = 0.300, Contrast = 0.704, Connect. = 0.812 for dens.mod. cycle 5 = 0.300, Contrast = 0.711, Connect. = 0.814 for dens.mod. cycle 6 = 0.300, Contrast = 0.718, Connect. = 0.815 for dens.mod. cycle 7 = 0.300, Contrast = 0.721, Connect. = 0.817 for dens.mod. cycle 8 = 0.300, Contrast = 0.724, Connect. = 0.817 for dens.mod. cycle 9 = 0.300, Contrast = 0.726, Connect. = 0.818 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4489 peaks > 0.5 sigma used to seed fragment search Space for about 1045 unique residues taking solvent into account 1054 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 16 42.781 2.467 0.895 0.817 1.000 0.867 CB 1.794 B: 20 31.639 2.422 0.877 0.510 0.842 0.579 CB 1.876 C: 15 38.890 2.418 0.748 0.904 1.000 0.929 CA 1.751 D: 12 30.085 2.413 0.642 0.907 0.909 0.455 CA 1.790 E: 15 26.400 2.337 0.586 0.791 0.929 0.643 CA 1.588 14 residues pruned to eliminate duplicates F: 14 29.667 2.305 0.770 0.853 0.923 0.923 CB 1.615 14 residues pruned to eliminate duplicates G: 15 42.644 2.396 1.053 0.911 0.929 0.857 CB 1.768 15 residues pruned to eliminate duplicates H: 15 27.930 2.222 0.741 0.921 0.929 0.857 CB 1.462 I: 15 32.116 2.239 0.883 0.927 1.000 0.929 CB 1.427 15 residues pruned to eliminate duplicates J: 16 54.095 2.392 1.319 0.915 1.000 0.733 CB 1.780 15 residues pruned to eliminate duplicates K: 12 23.332 2.521 0.505 0.839 0.818 0.545 CA 1.692 12 residues pruned to eliminate duplicates L: 20 50.378 2.530 0.813 0.907 0.947 0.842 CB 1.891 M: 37 52.503 2.373 0.713 0.876 0.944 0.722 CB 1.656 20 residues pruned to eliminate duplicates N: 12 21.024 2.250 0.751 0.774 0.909 0.636 CB 1.389 O: 24 32.342 2.170 0.766 0.852 0.913 0.826 CB 1.425 P: 10 38.188 2.671 0.836 0.854 1.000 0.667 CA 1.918 13 residues pruned to eliminate duplicates Q: 15 27.876 2.236 0.599 0.932 1.000 0.857 CB 1.454 15 residues pruned to eliminate duplicates R: 20 43.291 2.304 0.870 0.930 1.000 0.632 CB 1.611 20 residues pruned to eliminate duplicates S: 90 50.578 2.188 0.810 0.630 0.876 0.596 CB 1.367 24 residues pruned to eliminate duplicates T: 14 35.156 2.278 0.956 0.930 1.000 0.923 CB 1.531 15 residues pruned to eliminate duplicates U: 38 48.862 2.348 0.620 0.864 0.946 0.703 CB 1.637 38 residues pruned to eliminate duplicates V: 14 19.885 2.196 0.769 0.388 1.000 0.769 CB 1.599 W: 15 41.066 2.340 0.858 0.924 1.000 0.857 CB 1.774 15 residues pruned to eliminate duplicates X: 15 8.570 1.791 1.049 0.403 0.786 0.643 CB 0.879 15 residues pruned to eliminate duplicates Y: 51 43.484 2.239 0.796 0.587 0.920 0.560 CB 1.529 Z: 14 40.955 2.518 0.726 0.941 1.000 1.000 CB 1.814 14 residues pruned to eliminate duplicates Z: 35 31.623 2.193 0.598 0.642 0.941 0.824 CB 1.440 44 residues pruned to eliminate duplicates Z: 13 24.513 2.278 0.486 0.817 0.917 0.750 CA 1.732 13 residues pruned to eliminate duplicates Z: 29 23.433 2.195 0.640 0.420 0.821 0.464 CB 1.628 28 residues pruned to eliminate duplicates Z: 12 48.687 2.547 1.211 0.942 1.000 0.909 CB 1.808 12 residues pruned to eliminate duplicates Z: 14 35.088 2.379 0.699 0.929 1.000 0.923 CB 1.685 13 residues pruned to eliminate duplicates Z: 22 45.392 2.447 0.718 0.863 0.952 0.762 CB 1.815 21 residues pruned to eliminate duplicates Z: 29 39.076 2.464 0.719 0.540 0.929 0.607 CB 1.804 10 residues pruned to eliminate duplicates Z: 16 32.577 2.292 0.715 0.852 1.000 0.867 CA 1.583 19 residues pruned to eliminate duplicates Z: 22 45.843 2.333 0.799 0.911 1.000 0.857 CB 1.689 22 residues pruned to eliminate duplicates Z: 16 25.861 2.248 0.580 0.768 0.933 0.667 CB 1.588 12 residues pruned to eliminate duplicates Z: 18 17.973 2.225 0.667 0.474 0.824 0.588 CB 1.465 Z: 14 34.662 2.342 0.848 0.844 0.923 0.692 CA 1.791 14 residues pruned to eliminate duplicates Z: 30 37.274 2.359 0.659 0.610 0.931 0.724 CB 1.711 16 residues pruned to eliminate duplicates Z: 30 32.188 2.348 0.724 0.437 0.862 0.517 CB 1.829 30 residues pruned to eliminate duplicates Z: 20 28.259 2.450 0.736 0.500 0.842 0.526 CB 1.810 20 residues pruned to eliminate duplicates Z: 21 41.820 2.386 0.742 0.892 0.900 0.700 CB 1.795 21 residues pruned to eliminate duplicates Z: 18 18.129 2.099 0.684 0.526 0.882 0.647 CB 1.373 18 residues pruned to eliminate duplicates Z: 21 34.804 2.185 0.617 0.921 1.000 0.850 CB 1.550 21 residues pruned to eliminate duplicates Z: 31 37.176 2.442 0.697 0.518 0.900 0.600 CB 1.787 28 residues pruned to eliminate duplicates Z: 13 27.252 2.275 0.876 0.777 0.917 0.583 CB 1.575 13 residues pruned to eliminate duplicates Z: 14 30.837 2.376 0.595 0.903 1.000 0.769 CB 1.609 14 residues pruned to eliminate duplicates Z: 100 61.430 2.297 0.752 0.564 0.929 0.636 CB 1.552 53 residues pruned to eliminate duplicates Z: 38 32.057 2.055 0.749 0.621 0.865 0.568 CB 1.512 22 residues pruned to eliminate duplicates Z: 27 52.162 2.476 0.989 0.649 0.962 0.731 CB 1.879 16 residues pruned to eliminate duplicates Z: 34 41.524 2.208 0.739 0.858 0.939 0.697 CB 1.475 34 residues pruned to eliminate duplicates Z: 15 40.182 2.454 1.020 0.878 0.929 0.857 CB 1.693 15 residues pruned to eliminate duplicates Z: 15 45.661 2.393 1.125 0.921 0.929 0.857 CA 1.819 15 residues pruned to eliminate duplicates Z: 10 23.192 2.200 0.928 0.866 0.889 0.667 CB 1.501 10 residues pruned to eliminate duplicates Z: 14 58.691 2.517 1.480 0.949 1.000 0.923 CB 1.800 14 residues pruned to eliminate duplicates Z: 20 17.341 1.956 0.906 0.492 0.737 0.421 CB 1.460 Z: 25 36.803 2.450 0.912 0.458 0.917 0.500 CB 1.826 Z: 17 44.120 2.448 1.152 0.787 0.938 0.750 CA 1.736 17 residues pruned to eliminate duplicates Z: 23 16.552 2.034 0.903 0.421 0.773 0.455 CB 1.281 8 residues pruned to eliminate duplicates Z: 13 20.971 2.206 0.463 0.876 0.917 0.583 CA 1.487 13 residues pruned to eliminate duplicates Z: 16 31.068 2.282 1.051 0.754 0.867 0.533 CB 1.578 16 residues pruned to eliminate duplicates Z: 15 18.278 2.284 0.453 0.400 0.929 0.571 CB 1.761 15 residues pruned to eliminate duplicates Z: 13 29.751 2.388 0.491 0.929 1.000 0.917 CB 1.688 13 residues pruned to eliminate duplicates Z: 14 39.643 2.502 1.152 0.886 0.923 0.846 CB 1.596 14 residues pruned to eliminate duplicates Z: 11 28.836 2.598 0.556 0.834 0.900 0.500 CA 1.879 11 residues pruned to eliminate duplicates Z: 15 14.693 2.051 0.490 0.388 0.929 0.857 CB 1.559 14 residues pruned to eliminate duplicates Z: 15 54.687 2.394 1.292 0.930 1.000 0.857 CB 1.862 15 residues pruned to eliminate duplicates Z: 13 31.113 2.281 1.026 0.811 1.000 0.750 CB 1.483 13 residues pruned to eliminate duplicates Z: 26 34.808 2.332 0.686 0.555 0.920 0.600 CB 1.824 26 residues pruned to eliminate duplicates Z: 24 41.269 2.366 1.023 0.602 0.913 0.739 CB 1.786 24 residues pruned to eliminate duplicates Z: 15 27.495 2.166 1.332 0.522 0.857 0.643 CB 1.661 15 residues pruned to eliminate duplicates Z: 17 23.930 2.035 0.444 0.885 0.938 0.875 CA 1.568 Z: 15 22.826 2.161 0.389 0.835 0.929 0.786 CA 1.639 Z: 21 32.788 2.351 0.843 0.481 0.950 0.450 CA 1.815 20 residues pruned to eliminate duplicates Z: 52 49.619 2.278 0.848 0.603 0.902 0.549 CB 1.659 52 residues pruned to eliminate duplicates Z: 15 27.877 2.389 0.825 0.557 0.929 0.571 CB 1.741 15 residues pruned to eliminate duplicates Z: 18 35.290 1.996 0.981 0.921 1.000 0.706 CB 1.523 18 residues pruned to eliminate duplicates Z: 18 24.757 1.993 0.382 0.910 1.000 0.824 CA 1.546 18 residues pruned to eliminate duplicates Z: 13 27.377 2.215 0.829 0.829 0.917 0.583 CB 1.601 13 residues pruned to eliminate duplicates Z: 33 35.583 2.367 0.656 0.522 0.938 0.562 CA 1.676 31 residues pruned to eliminate duplicates Z: 16 28.408 2.296 0.605 0.849 0.933 0.867 CA 1.581 16 residues pruned to eliminate duplicates Z: 21 39.026 2.221 0.884 0.902 1.000 0.750 CB 1.488 21 residues pruned to eliminate duplicates Z: 14 40.120 2.412 1.066 0.865 0.923 0.923 CB 1.772 14 residues pruned to eliminate duplicates Z: 21 42.376 2.308 0.941 0.903 0.950 0.650 CB 1.587 21 residues pruned to eliminate duplicates Z: 29 36.076 2.381 0.886 0.468 0.857 0.571 CA 1.829 29 residues pruned to eliminate duplicates Z: 22 21.782 1.999 0.554 0.534 0.952 0.714 CB 1.554 Z: 17 28.970 2.060 0.573 0.948 1.000 0.688 CB 1.543 16 residues pruned to eliminate duplicates Z: 21 39.346 2.258 0.721 0.929 1.000 0.800 CB 1.584 21 residues pruned to eliminate duplicates Z: 15 45.886 2.421 1.115 0.901 0.929 0.857 CB 1.841 15 residues pruned to eliminate duplicates Z: 11 25.873 2.433 0.850 0.814 0.800 0.800 CA 1.729 11 residues pruned to eliminate duplicates Z: 16 29.758 2.284 0.907 0.803 0.867 0.600 CB 1.562 16 residues pruned to eliminate duplicates Z: 13 46.293 2.520 1.091 0.946 1.000 0.917 CB 1.753 18 residues pruned to eliminate duplicates Z: 29 20.416 1.984 0.742 0.494 0.857 0.643 CB 1.309 Z: 31 35.381 2.435 0.710 0.504 0.900 0.567 CB 1.718 31 residues pruned to eliminate duplicates Z: 14 43.385 2.494 0.917 0.929 1.000 0.846 CB 1.761 14 residues pruned to eliminate duplicates Z: 15 27.855 2.348 0.647 0.823 0.929 0.714 CB 1.567 15 residues pruned to eliminate duplicates Z: 27 26.203 2.001 0.906 0.547 0.962 0.692 CB 1.338 29 residues pruned to eliminate duplicates Z: 21 44.990 2.261 0.981 0.945 1.000 0.650 CB 1.555 21 residues pruned to eliminate duplicates Z: 7 10.866 2.011 0.522 0.594 1.000 0.333 CB 1.324 7 residues pruned to eliminate duplicates Z: 38 48.885 2.297 0.789 0.847 0.892 0.676 CB 1.627 38 residues pruned to eliminate duplicates Z: 29 34.167 2.295 0.822 0.454 0.893 0.500 CB 1.813 29 residues pruned to eliminate duplicates Z: 22 40.544 2.352 0.558 0.893 0.952 0.762 CB 1.820 22 residues pruned to eliminate duplicates Z: 23 39.077 2.348 0.696 0.862 0.909 0.773 CB 1.690 23 residues pruned to eliminate duplicates Z: 13 32.890 2.375 0.711 0.915 1.000 1.000 CB 1.651 13 residues pruned to eliminate duplicates Z: 13 10.635 2.006 0.072 0.887 0.833 0.750 CB 1.235 13 residues pruned to eliminate duplicates Z: 14 44.383 2.429 1.193 0.870 1.000 0.769 CB 1.686 14 residues pruned to eliminate duplicates Z: 18 28.300 1.935 0.910 0.918 1.000 0.294 CB 1.310 18 residues pruned to eliminate duplicates Z: 17 15.272 1.850 0.772 0.467 0.938 0.375 CB 1.284 14 residues pruned to eliminate duplicates Z: 20 47.574 2.443 0.727 0.922 1.000 0.737 CB 1.819 20 residues pruned to eliminate duplicates Z: 37 33.150 2.074 0.548 0.853 0.944 0.667 CB 1.346 37 residues pruned to eliminate duplicates Z: 15 31.892 2.264 0.781 0.940 1.000 0.929 CB 1.468 15 residues pruned to eliminate duplicates Z: 22 38.144 2.182 0.656 0.924 1.000 0.905 CB 1.618 22 residues pruned to eliminate duplicates Z: 18 28.835 1.997 0.642 0.920 1.000 0.706 CB 1.502 18 residues pruned to eliminate duplicates Z: 6 3.800 1.765 0.333 0.695 0.600 0.400 CA 1.008 6 residues pruned to eliminate duplicates Z: 36 35.364 2.283 0.653 0.573 0.914 0.686 CB 1.614 36 residues pruned to eliminate duplicates Z: 18 25.491 2.005 0.399 0.906 1.000 0.941 CB 1.567 18 residues pruned to eliminate duplicates Z: 30 36.773 2.417 0.729 0.462 0.897 0.586 CA 1.895 30 residues pruned to eliminate duplicates Z: 25 39.548 2.419 1.088 0.533 0.917 0.625 CB 1.688 25 residues pruned to eliminate duplicates Z: 7 13.963 2.080 0.825 0.763 1.000 0.667 CA 1.189 6 residues pruned to eliminate duplicates Z: 15 21.093 2.493 0.625 0.350 0.929 0.357 CB 1.762 15 residues pruned to eliminate duplicates Z: 16 46.266 2.491 1.005 0.837 1.000 0.867 CB 1.788 16 residues pruned to eliminate duplicates Z: 26 32.441 2.411 0.722 0.438 0.920 0.440 CB 1.812 26 residues pruned to eliminate duplicates Z: 38 39.113 2.274 0.922 0.512 0.919 0.703 CB 1.581 37 residues pruned to eliminate duplicates Z: 6 10.077 2.041 0.671 0.605 1.000 0.600 CB 1.196 6 residues pruned to eliminate duplicates Z: 18 36.232 2.031 1.109 0.934 1.000 0.765 CB 1.430 18 residues pruned to eliminate duplicates Z: 11 33.746 2.651 0.708 0.840 0.900 0.600 CA 1.955 11 residues pruned to eliminate duplicates Z: 13 28.361 2.290 0.657 0.860 1.000 0.583 CA 1.586 13 residues pruned to eliminate duplicates Z: 39 34.619 2.292 0.849 0.438 0.868 0.632 CB 1.627 45 residues pruned to eliminate duplicates Z: 28 45.247 2.331 0.727 0.844 1.000 0.815 CB 1.609 28 residues pruned to eliminate duplicates Z: 20 25.681 2.086 0.645 0.544 1.000 0.737 CB 1.645 22 residues pruned to eliminate duplicates Z: 12 20.668 2.340 0.612 0.469 1.000 0.636 CB 1.705 12 residues pruned to eliminate duplicates Z: 17 22.236 2.058 0.479 0.850 0.938 0.750 CB 1.443 17 residues pruned to eliminate duplicates Z: 19 16.115 1.963 0.527 0.701 0.833 0.556 CB 1.267 19 residues pruned to eliminate duplicates Z: 17 22.458 2.035 0.254 0.913 1.000 0.812 CA 1.557 17 residues pruned to eliminate duplicates Z: 33 12.633 1.810 0.525 0.382 0.750 0.469 CB 1.223 Z: 29 46.614 2.399 0.859 0.595 1.000 0.714 CB 1.804 29 residues pruned to eliminate duplicates Z: 17 21.433 2.035 0.463 0.864 0.938 0.875 CB 1.407 17 residues pruned to eliminate duplicates Z: 32 43.074 2.361 0.829 0.552 0.935 0.581 CB 1.821 31 residues pruned to eliminate duplicates Z: 16 43.688 2.345 1.158 0.917 0.867 0.867 CB 1.814 16 residues pruned to eliminate duplicates Z: 13 31.131 2.427 0.773 0.686 0.917 0.583 CB 1.922 13 residues pruned to eliminate duplicates Z: 15 24.878 2.116 0.452 0.940 1.000 0.929 CB 1.503 15 residues pruned to eliminate duplicates Z: 12 10.105 1.776 0.375 0.755 0.818 0.727 CB 1.216 10 residues pruned to eliminate duplicates Z: 25 28.332 2.085 0.967 0.579 0.917 0.750 CB 1.425 27 residues pruned to eliminate duplicates Z: 35 34.655 2.322 0.818 0.477 0.853 0.559 CB 1.690 35 residues pruned to eliminate duplicates Z: 15 26.257 2.003 0.617 0.918 1.000 0.714 CB 1.529 15 residues pruned to eliminate duplicates Z: 36 35.553 2.164 0.540 0.847 0.943 0.829 CB 1.419 36 residues pruned to eliminate duplicates Z: 15 15.567 2.131 0.591 0.373 0.929 0.714 CB 1.513 15 residues pruned to eliminate duplicates Z: 14 10.199 2.032 0.564 0.385 0.692 0.538 CA 1.452 14 residues pruned to eliminate duplicates Z: 29 18.295 2.130 0.754 0.427 0.786 0.429 CB 1.270 21 residues pruned to eliminate duplicates Z: 7 13.332 2.193 1.016 0.398 0.833 0.333 CB 1.646 7 residues pruned to eliminate duplicates Z: 15 45.680 2.412 1.167 0.910 0.929 0.857 CB 1.784 14 residues pruned to eliminate duplicates Z: 14 19.781 2.010 0.858 0.523 1.000 0.769 CB 1.437 Z: 17 30.478 2.062 0.671 0.949 1.000 0.500 CB 1.526 18 residues pruned to eliminate duplicates Z: 14 38.133 2.366 0.972 0.904 0.923 0.923 CB 1.749 14 residues pruned to eliminate duplicates Z: 30 46.139 2.319 1.123 0.556 0.931 0.724 CB 1.771 30 residues pruned to eliminate duplicates Z: 11 4.876 1.775 0.139 0.438 0.800 0.500 CB 1.017 Z: 13 18.571 2.340 0.752 0.401 0.833 0.333 CB 1.742 13 residues pruned to eliminate duplicates Z: 9 5.960 1.607 0.543 0.608 0.750 0.625 CB 1.022 9 residues pruned to eliminate duplicates Z: 35 31.029 2.047 0.925 0.644 1.000 0.500 CB 1.180 Z: 11 10.455 2.086 -0.121 0.918 1.000 0.900 CB 1.271 11 residues pruned to eliminate duplicates Z: 15 28.087 2.269 0.749 0.779 0.929 0.643 CB 1.592 15 residues pruned to eliminate duplicates Z: 56 45.885 2.269 0.773 0.575 0.891 0.655 CB 1.606 56 residues pruned to eliminate duplicates Z: 25 24.379 2.010 0.993 0.527 0.917 0.583 CB 1.320 25 residues pruned to eliminate duplicates Z: 9 24.204 2.458 0.468 0.917 1.000 0.875 CA 1.674 9 residues pruned to eliminate duplicates Z: 25 31.677 2.241 0.763 0.652 0.917 0.708 CB 1.550 25 residues pruned to eliminate duplicates Z: 19 13.318 1.889 0.711 0.317 0.833 0.444 CB 1.426 21 residues pruned to eliminate duplicates Z: 103 49.719 2.141 0.637 0.649 0.873 0.686 CB 1.401 103 residues pruned to eliminate duplicates Z: 21 48.808 2.457 0.877 0.874 1.000 0.850 CB 1.722 21 residues pruned to eliminate duplicates Z: 15 31.074 2.115 0.743 0.935 1.000 0.929 CB 1.569 15 residues pruned to eliminate duplicates Z: 13 13.883 1.992 0.567 0.433 1.000 0.750 CB 1.375 Z: 18 28.227 2.000 0.611 0.918 1.000 0.941 CB 1.498 18 residues pruned to eliminate duplicates Z: 7 11.512 2.113 0.880 0.383 0.833 0.667 CA 1.607 7 residues pruned to eliminate duplicates Z: 16 9.978 1.892 0.731 0.390 0.867 0.467 CB 1.019 13 residues pruned to eliminate duplicates Z: 17 31.309 2.182 0.761 0.806 1.000 0.625 CA 1.560 17 residues pruned to eliminate duplicates Z: 83 49.356 2.168 0.664 0.648 0.939 0.646 CB 1.401 83 residues pruned to eliminate duplicates Z: 11 16.821 2.126 0.585 0.919 1.000 0.900 CB 1.112 Z: 18 23.213 1.933 0.380 0.902 1.000 0.941 CB 1.506 18 residues pruned to eliminate duplicates Z: 36 29.623 2.141 0.904 0.562 0.857 0.400 CB 1.350 36 residues pruned to eliminate duplicates Z: 80 49.890 2.254 0.694 0.560 0.911 0.544 CB 1.521 67 residues pruned to eliminate duplicates Z: 13 18.549 1.961 0.565 0.870 0.917 0.750 CB 1.389 14 residues pruned to eliminate duplicates Z: 15 26.769 2.109 0.728 0.947 0.929 0.786 CB 1.462 15 residues pruned to eliminate duplicates Z: 29 42.687 2.385 0.737 0.630 0.964 0.714 CB 1.787 29 residues pruned to eliminate duplicates Z: 68 45.637 2.279 0.605 0.591 0.925 0.597 CB 1.510 68 residues pruned to eliminate duplicates Z: 14 31.504 2.371 0.774 0.817 0.923 0.769 CB 1.710 14 residues pruned to eliminate duplicates Z: 21 40.558 2.270 0.846 0.915 0.950 0.750 CB 1.610 21 residues pruned to eliminate duplicates Z: 17 34.382 2.056 0.958 0.921 1.000 0.562 CB 1.502 17 residues pruned to eliminate duplicates Z: 13 34.789 2.444 0.978 0.655 0.917 0.583 CB 1.962 13 residues pruned to eliminate duplicates Z: 15 31.346 2.115 0.804 0.933 1.000 0.857 CB 1.533 15 residues pruned to eliminate duplicates Z: 40 47.885 2.254 0.615 0.865 0.949 0.744 CB 1.626 40 residues pruned to eliminate duplicates Z: 25 23.569 2.077 0.768 0.518 0.917 0.583 CB 1.403 25 residues pruned to eliminate duplicates Z: 46 38.762 2.299 0.525 0.569 0.956 0.622 CB 1.614 64 residues pruned to eliminate duplicates Z: 12 17.082 2.196 0.513 0.450 0.909 0.636 CB 1.794 13 residues pruned to eliminate duplicates Z: 11 16.629 1.880 0.502 0.858 1.000 0.800 CB 1.372 11 residues pruned to eliminate duplicates Z: 15 18.266 2.013 0.830 0.503 0.929 0.643 CB 1.422 15 residues pruned to eliminate duplicates Z: 14 25.349 2.199 0.663 0.908 1.000 0.846 CB 1.366 14 residues pruned to eliminate duplicates Z: 6 4.733 1.903 0.617 0.297 0.600 0.400 CA 1.439 6 residues pruned to eliminate duplicates Z: 15 26.742 2.102 0.592 0.934 1.000 0.929 CB 1.490 15 residues pruned to eliminate duplicates Z: 17 31.336 2.028 0.768 0.944 1.000 0.938 CB 1.513 24 residues pruned to eliminate duplicates Z: 13 23.679 2.267 0.485 0.845 0.917 0.667 CA 1.646 13 residues pruned to eliminate duplicates Z: 10 20.014 2.073 0.652 0.912 1.000 0.667 CB 1.380 10 residues pruned to eliminate duplicates Z: 100 53.162 2.159 0.798 0.554 0.909 0.616 CB 1.437 99 residues pruned to eliminate duplicates Z: 17 27.658 2.326 0.713 0.597 0.875 0.688 CB 1.808 17 residues pruned to eliminate duplicates Z: 16 27.637 2.379 0.618 0.597 0.933 0.533 CB 1.812 16 residues pruned to eliminate duplicates Z: 13 18.511 2.253 0.610 0.815 0.750 0.500 CB 1.493 13 residues pruned to eliminate duplicates Z: 15 23.456 2.182 0.464 0.928 0.929 0.929 CB 1.480 15 residues pruned to eliminate duplicates Z: 14 39.234 2.478 0.751 0.933 1.000 0.846 CB 1.749 14 residues pruned to eliminate duplicates Z: 15 13.504 1.854 0.258 0.883 1.000 0.786 CB 1.118 15 residues pruned to eliminate duplicates Z: 12 12.204 1.906 0.921 0.827 0.909 0.636 CB 0.833 12 residues pruned to eliminate duplicates Z: 18 28.841 2.011 0.617 0.933 1.000 0.706 CB 1.501 18 residues pruned to eliminate duplicates Z: 29 45.819 2.451 0.916 0.554 1.000 0.714 CB 1.750 29 residues pruned to eliminate duplicates Z: 37 53.286 2.404 0.684 0.874 0.944 0.722 CB 1.690 37 residues pruned to eliminate duplicates Z: 32 34.793 2.402 0.764 0.479 0.871 0.645 CB 1.730 32 residues pruned to eliminate duplicates Z: 12 21.976 2.226 0.820 0.825 0.909 0.636 CB 1.357 12 residues pruned to eliminate duplicates Z: 14 38.151 2.497 0.712 0.911 1.000 0.769 CB 1.754 14 residues pruned to eliminate duplicates Z: 15 23.314 1.922 0.826 0.803 0.929 0.786 CA 1.467 Z: 26 32.309 2.329 0.438 0.812 0.920 0.760 CB 1.598 26 residues pruned to eliminate duplicates Z: 8 8.029 1.563 0.341 0.889 1.000 0.857 N 1.042 8 residues pruned to eliminate duplicates Z: 16 25.670 2.198 0.493 0.836 1.000 0.733 CA 1.512 16 residues pruned to eliminate duplicates Z: 14 35.215 2.277 0.973 0.930 1.000 0.692 CB 1.520 14 residues pruned to eliminate duplicates Z: 16 33.660 2.244 0.978 0.767 0.933 0.733 CB 1.656 16 residues pruned to eliminate duplicates Z: 6 4.444 1.982 -0.156 0.679 1.000 0.800 CB 1.007 6 residues pruned to eliminate duplicates Z: 27 16.527 1.823 0.474 0.568 0.885 0.731 CB 1.277 27 residues pruned to eliminate duplicates Z: 29 45.079 2.331 0.987 0.586 0.964 0.643 CB 1.755 29 residues pruned to eliminate duplicates Z: 11 14.690 2.011 0.497 0.445 1.000 0.800 CB 1.634 Z: 36 35.375 2.159 0.659 0.831 0.886 0.657 CB 1.416 36 residues pruned to eliminate duplicates Z: 18 17.033 2.315 0.673 0.326 0.824 0.412 CB 1.569 18 residues pruned to eliminate duplicates Z: 14 21.293 2.129 0.695 0.751 0.846 0.692 CB 1.546 14 residues pruned to eliminate duplicates Z: 13 21.560 2.341 0.429 0.848 0.833 0.667 CA 1.656 13 residues pruned to eliminate duplicates Z: 8 6.800 1.746 1.191 0.308 0.571 0.429 N 1.455 8 residues pruned to eliminate duplicates Z: 25 26.666 2.260 0.543 0.450 0.917 0.417 CB 1.792 25 residues pruned to eliminate duplicates Z: 13 17.893 1.977 0.380 0.875 1.000 0.750 CB 1.377 13 residues pruned to eliminate duplicates Z: 25 21.998 2.072 0.774 0.526 0.875 0.667 CB 1.360 25 residues pruned to eliminate duplicates Z: 14 15.655 2.114 0.562 0.470 0.923 0.615 CB 1.468 14 residues pruned to eliminate duplicates Z: 14 10.614 1.928 0.038 0.894 1.000 0.769 CB 1.055 14 residues pruned to eliminate duplicates Z: 39 28.806 1.957 0.806 0.587 0.868 0.737 CB 1.400 39 residues pruned to eliminate duplicates Z: 33 34.346 2.317 0.882 0.471 0.906 0.469 CB 1.582 33 residues pruned to eliminate duplicates Z: 20 16.847 2.007 0.719 0.399 0.895 0.421 CB 1.393 20 residues pruned to eliminate duplicates Z: 16 36.176 2.306 1.065 0.837 0.933 0.467 CB 1.572 16 residues pruned to eliminate duplicates Z: 11 11.496 1.888 0.327 0.755 0.900 0.600 CB 1.285 11 residues pruned to eliminate duplicates Z: 32 15.098 1.976 0.420 0.419 0.806 0.419 CB 1.304 24 residues pruned to eliminate duplicates Z: 18 7.549 1.832 0.482 0.266 0.647 0.529 CB 1.360 18 residues pruned to eliminate duplicates Z: 63 37.251 2.127 0.692 0.576 0.887 0.597 CB 1.377 141 residues pruned to eliminate duplicates Z: 24 34.844 2.188 0.736 0.825 1.000 0.739 CB 1.443 24 residues pruned to eliminate duplicates Z: 20 19.323 1.977 0.916 0.480 0.895 0.526 CB 1.334 20 residues pruned to eliminate duplicates Z: 17 24.588 1.975 0.514 0.910 1.000 1.000 CB 1.457 17 residues pruned to eliminate duplicates Z: 15 22.467 2.069 0.344 0.916 1.000 0.857 CB 1.525 15 residues pruned to eliminate duplicates Z: 14 25.770 2.260 0.794 0.566 1.000 0.846 CB 1.654 14 residues pruned to eliminate duplicates Z: 27 39.470 2.381 1.042 0.572 0.923 0.692 CB 1.608 27 residues pruned to eliminate duplicates Z: 14 9.251 1.815 0.183 0.442 0.923 0.692 CB 1.374 13 residues pruned to eliminate duplicates Z: 7 6.178 1.940 -0.316 0.761 1.000 0.833 N 1.506 Z: 46 44.048 2.139 0.861 0.673 0.933 0.600 CB 1.507 46 residues pruned to eliminate duplicates Z: 17 26.774 2.068 0.475 0.923 1.000 0.875 CB 1.542 17 residues pruned to eliminate duplicates Z: 14 12.632 2.188 0.809 0.444 0.615 0.462 CB 1.524 14 residues pruned to eliminate duplicates Z: 15 29.631 2.116 0.711 0.934 1.000 0.857 CB 1.525 15 residues pruned to eliminate duplicates Z: 14 10.082 2.039 0.896 0.405 0.692 0.538 CB 1.155 14 residues pruned to eliminate duplicates Z: 19 23.489 1.941 0.671 0.877 0.889 0.889 CB 1.395 19 residues pruned to eliminate duplicates Z: 12 30.557 2.443 0.588 0.870 1.000 0.818 CB 1.734 12 residues pruned to eliminate duplicates Z: 18 32.246 2.078 0.754 0.941 1.000 0.941 CB 1.490 18 residues pruned to eliminate duplicates Z: 35 37.564 2.189 0.578 0.849 0.941 0.765 CB 1.469 35 residues pruned to eliminate duplicates Z: 20 11.450 1.896 0.731 0.424 0.737 0.526 CB 1.176 20 residues pruned to eliminate duplicates Z: 13 26.219 2.208 0.891 0.783 0.917 0.500 CB 1.542 Z: 17 25.396 2.057 0.394 0.919 1.000 0.812 CB 1.560 17 residues pruned to eliminate duplicates Z: 6 4.699 1.821 -0.144 0.681 0.800 0.800 C 1.427 Z: 70 47.841 2.190 0.823 0.571 0.913 0.652 CB 1.474 65 residues pruned to eliminate duplicates Z: 27 17.421 1.890 0.616 0.528 0.885 0.615 CB 1.230 Z: 36 35.688 2.287 0.593 0.639 0.914 0.743 CB 1.589 36 residues pruned to eliminate duplicates Z: 27 25.803 2.022 0.824 0.747 0.885 0.615 CB 1.243 27 residues pruned to eliminate duplicates Z: 26 22.697 2.020 0.835 0.509 0.880 0.640 CB 1.379 26 residues pruned to eliminate duplicates Z: 17 30.408 2.067 0.653 0.932 1.000 0.750 CB 1.554 17 residues pruned to eliminate duplicates Z: 13 12.686 1.930 0.826 0.509 0.833 0.583 CB 1.236 13 residues pruned to eliminate duplicates Z: 40 39.777 2.186 1.000 0.591 0.897 0.615 CB 1.489 40 residues pruned to eliminate duplicates Z: 35 24.934 2.226 0.464 0.548 0.824 0.647 CB 1.521 35 residues pruned to eliminate duplicates Z: 6 10.876 2.029 0.095 0.887 1.000 1.000 CA 1.579 6 residues pruned to eliminate duplicates Z: 16 34.245 2.278 0.880 0.827 1.000 0.733 CB 1.555 Z: 11 12.863 2.150 0.517 0.390 1.000 0.700 CB 1.401 11 residues pruned to eliminate duplicates Z: 15 23.103 2.108 0.343 0.932 1.000 1.000 CB 1.524 15 residues pruned to eliminate duplicates Z: 13 28.821 2.235 0.693 0.934 1.000 0.917 CB 1.533 13 residues pruned to eliminate duplicates Z: 17 27.606 2.015 0.712 0.938 0.938 0.875 CB 1.484 17 residues pruned to eliminate duplicates Z: 25 20.062 1.961 0.705 0.439 0.917 0.583 CB 1.422 25 residues pruned to eliminate duplicates Z: 49 34.422 2.233 0.671 0.490 0.896 0.604 CB 1.501 49 residues pruned to eliminate duplicates Z: 16 22.674 1.980 0.555 0.920 1.000 1.000 CB 1.338 16 residues pruned to eliminate duplicates Z: 12 19.048 1.881 0.632 0.818 1.000 0.545 CB 1.419 12 residues pruned to eliminate duplicates Z: 8 19.017 2.156 1.229 0.637 0.857 0.714 CB 1.534 8 residues pruned to eliminate duplicates Z: 24 13.045 2.038 0.842 0.330 0.783 0.348 CB 1.115 24 residues pruned to eliminate duplicates Z: 13 11.196 1.903 0.123 0.866 1.000 0.833 CB 1.107 13 residues pruned to eliminate duplicates Z: 8 12.012 1.808 0.768 0.869 0.857 0.714 CB 1.211 8 residues pruned to eliminate duplicates Z: 12 15.655 1.846 0.417 0.823 1.000 0.636 CB 1.364 12 residues pruned to eliminate duplicates Z: 17 32.001 1.973 0.996 0.938 1.000 0.625 CB 1.413 22 residues pruned to eliminate duplicates Z: 9 17.511 2.290 0.690 0.502 0.875 0.750 C 1.825 9 residues pruned to eliminate duplicates Z: 33 28.149 2.058 0.791 0.650 0.969 0.656 CB 1.211 33 residues pruned to eliminate duplicates Z: 29 30.865 2.303 0.684 0.675 0.893 0.607 CB 1.433 29 residues pruned to eliminate duplicates Z: 13 14.094 2.188 1.133 0.351 0.750 0.333 CA 1.366 13 residues pruned to eliminate duplicates Z: 15 19.177 1.997 0.447 0.846 0.929 0.857 CB 1.419 15 residues pruned to eliminate duplicates Z: 15 17.073 2.137 0.621 0.460 0.929 0.500 CB 1.478 15 residues pruned to eliminate duplicates Z: 22 12.526 2.041 0.644 0.482 0.762 0.429 CB 1.089 22 residues pruned to eliminate duplicates Z: 19 16.658 1.992 0.582 0.576 0.833 0.611 CB 1.388 19 residues pruned to eliminate duplicates Z: 21 42.658 2.367 0.678 0.925 0.950 0.700 CB 1.774 21 residues pruned to eliminate duplicates Z: 8 9.357 1.944 0.520 0.618 0.857 0.857 CB 1.249 8 residues pruned to eliminate duplicates Z: 12 15.428 1.954 0.801 0.867 0.818 0.727 CB 1.182 Z: 14 18.481 2.262 0.504 0.459 0.923 0.538 CB 1.701 14 residues pruned to eliminate duplicates Z: 20 21.240 2.167 0.641 0.509 0.895 0.579 CB 1.517 Z: 19 24.366 1.985 0.510 0.903 0.944 0.833 CA 1.446 19 residues pruned to eliminate duplicates Z: 14 24.281 2.007 1.023 0.803 0.846 0.769 CA 1.504 15 residues pruned to eliminate duplicates Z: 15 18.640 1.873 0.435 0.848 1.000 0.714 CA 1.375 15 residues pruned to eliminate duplicates Z: 21 8.182 1.714 0.382 0.383 0.850 0.600 CB 1.030 15 residues pruned to eliminate duplicates Z: 13 18.356 1.965 0.777 0.851 0.917 0.583 CB 1.226 13 residues pruned to eliminate duplicates Z: 17 33.292 2.053 0.870 0.937 1.000 0.938 CB 1.509 16 residues pruned to eliminate duplicates Z: 18 31.923 2.364 0.440 0.853 0.941 0.765 CB 1.786 18 residues pruned to eliminate duplicates Z: 9 22.132 2.431 0.785 0.798 1.000 0.625 CB 1.389 9 residues pruned to eliminate duplicates Z: 17 24.737 2.218 0.429 0.889 0.938 0.875 CB 1.499 17 residues pruned to eliminate duplicates Z: 15 44.988 2.490 1.072 0.912 1.000 0.929 CB 1.650 15 residues pruned to eliminate duplicates Z: 14 22.910 2.126 0.732 0.751 0.923 0.538 CB 1.494 15 residues pruned to eliminate duplicates Z: 16 30.639 1.996 0.842 0.932 1.000 0.867 CB 1.503 16 residues pruned to eliminate duplicates Z: 17 15.486 2.067 0.856 0.453 0.812 0.500 CB 1.303 17 residues pruned to eliminate duplicates Z: 20 13.804 1.826 0.638 0.451 0.842 0.526 CB 1.322 20 residues pruned to eliminate duplicates Z: 18 29.420 1.993 0.661 0.926 1.000 0.765 CB 1.511 18 residues pruned to eliminate duplicates Z: 8 10.751 1.787 0.500 0.831 1.000 0.429 CB 1.140 8 residues pruned to eliminate duplicates Z: 26 26.844 2.343 0.647 0.425 0.840 0.480 CA 1.791 26 residues pruned to eliminate duplicates Z: 21 30.764 2.471 0.632 0.543 0.900 0.700 CB 1.818 21 residues pruned to eliminate duplicates Z: 30 35.749 2.404 1.057 0.435 0.828 0.552 CB 1.734 30 residues pruned to eliminate duplicates Z: 19 11.517 1.740 0.589 0.432 0.889 0.611 CB 1.185 16 residues pruned to eliminate duplicates Z: 17 28.648 2.012 0.647 0.922 1.000 0.875 CB 1.520 17 residues pruned to eliminate duplicates Z: 29 34.300 2.416 0.713 0.474 0.893 0.679 CB 1.801 29 residues pruned to eliminate duplicates Z: 7 3.885 1.734 0.471 0.502 0.667 0.333 CB 0.931 Z: 12 7.379 1.845 0.376 0.447 0.818 0.545 CB 1.130 12 residues pruned to eliminate duplicates Z: 21 42.947 2.329 0.755 0.914 0.950 0.750 CB 1.750 21 residues pruned to eliminate duplicates Z: 17 31.465 2.231 0.769 0.840 1.000 0.312 CB 1.487 17 residues pruned to eliminate duplicates Z: 13 22.855 2.085 0.528 0.916 1.000 0.917 CA 1.463 12 residues pruned to eliminate duplicates Z: 7 3.801 1.744 0.517 0.405 0.667 0.500 CB 0.972 7 residues pruned to eliminate duplicates Z: 96 60.544 2.286 0.693 0.570 0.937 0.621 CB 1.600 96 residues pruned to eliminate duplicates Z: 13 17.481 1.994 0.679 0.774 1.000 0.583 CB 1.183 13 residues pruned to eliminate duplicates Z: 14 26.573 1.997 0.854 0.823 1.000 0.692 CA 1.505 14 residues pruned to eliminate duplicates Z: 20 47.102 2.420 0.728 0.918 1.000 0.842 CA 1.822 20 residues pruned to eliminate duplicates Z: 8 9.406 1.986 1.261 0.553 0.714 0.571 CB 1.052 8 residues pruned to eliminate duplicates Z: 18 22.942 2.019 0.612 0.537 0.941 0.706 C 1.752 32 residues pruned to eliminate duplicates Z: 16 16.361 2.111 0.746 0.530 0.933 0.600 CB 1.192 18 residues pruned to eliminate duplicates Z: 26 22.739 2.151 0.805 0.496 0.880 0.560 CB 1.336 24 residues pruned to eliminate duplicates Z: 71 41.248 2.146 0.552 0.648 0.929 0.643 CB 1.388 71 residues pruned to eliminate duplicates Z: 8 13.853 2.036 0.621 0.722 0.857 0.571 CB 1.514 9 residues pruned to eliminate duplicates Z: 17 28.840 2.024 0.635 0.918 1.000 0.875 CB 1.537 17 residues pruned to eliminate duplicates Z: 26 25.036 2.002 0.900 0.553 0.960 0.640 CB 1.302 26 residues pruned to eliminate duplicates Z: 12 27.550 2.070 0.915 0.852 1.000 0.909 CA 1.550 12 residues pruned to eliminate duplicates Z: 19 28.712 1.967 0.675 0.930 1.000 0.944 CB 1.437 19 residues pruned to eliminate duplicates Z: 59 45.664 2.328 0.583 0.597 0.948 0.586 CB 1.563 59 residues pruned to eliminate duplicates Z: 19 16.073 2.049 0.769 0.485 0.778 0.722 CB 1.365 19 residues pruned to eliminate duplicates Z: 18 27.173 1.973 0.859 0.926 0.941 0.294 CB 1.338 18 residues pruned to eliminate duplicates Z: 13 19.663 1.882 0.989 0.902 0.833 0.583 CB 1.298 13 residues pruned to eliminate duplicates Z: 17 13.228 1.966 0.609 0.535 0.875 0.625 CB 1.155 17 residues pruned to eliminate duplicates Z: 15 24.237 1.891 0.787 0.816 1.000 0.643 CB 1.457 15 residues pruned to eliminate duplicates Z: 7 2.271 1.370 -0.006 0.472 0.833 0.500 N 0.840 Z: 9 3.464 1.593 0.513 0.290 0.625 0.375 CB 1.030 Z: 7 4.946 1.801 -0.101 0.606 1.000 0.500 CB 1.128 Z: 16 24.907 2.278 0.742 0.738 0.867 0.533 CB 1.510 13 residues pruned to eliminate duplicates Z: 17 16.546 1.952 0.359 0.808 1.000 0.750 CB 1.193 17 residues pruned to eliminate duplicates Z: 22 14.438 2.145 0.714 0.401 0.762 0.476 CB 1.247 21 residues pruned to eliminate duplicates Z: 15 39.177 2.345 1.045 0.915 1.000 0.714 CB 1.544 15 residues pruned to eliminate duplicates Z: 22 22.291 2.083 0.568 0.732 0.857 0.762 CB 1.410 22 residues pruned to eliminate duplicates Z: 9 11.638 2.210 0.543 0.451 1.000 0.625 CB 1.269 9 residues pruned to eliminate duplicates Z: 94 49.492 2.165 0.679 0.571 0.925 0.634 CB 1.426 74 residues pruned to eliminate duplicates Z: 6 14.700 2.106 0.464 0.728 1.000 0.600 CA 1.737 6 residues pruned to eliminate duplicates Z: 20 26.074 2.256 0.598 0.794 0.895 0.526 CB 1.433 20 residues pruned to eliminate duplicates Z: 18 34.827 2.048 0.984 0.945 1.000 0.824 CB 1.439 18 residues pruned to eliminate duplicates Z: 14 47.363 2.489 1.121 0.945 1.000 0.923 CB 1.722 14 residues pruned to eliminate duplicates Z: 15 35.451 2.321 0.989 0.888 0.929 0.571 CB 1.592 15 residues pruned to eliminate duplicates Z: 65 52.825 2.230 0.989 0.577 0.906 0.578 CB 1.525 62 residues pruned to eliminate duplicates Z: 27 20.700 2.006 0.721 0.542 0.846 0.692 CB 1.333 27 residues pruned to eliminate duplicates Z: 33 32.410 2.356 0.718 0.437 0.844 0.500 CB 1.790 33 residues pruned to eliminate duplicates Z: 16 13.174 1.896 0.732 0.686 0.867 0.733 CB 1.008 7 residues pruned to eliminate duplicates Z: 8 5.367 1.891 -0.117 0.618 0.857 0.714 CB 1.267 7 residues pruned to eliminate duplicates Z: 37 33.499 2.241 0.587 0.480 0.944 0.667 CB 1.695 37 residues pruned to eliminate duplicates Z: 20 29.994 2.257 0.717 0.801 0.895 0.842 CB 1.525 20 residues pruned to eliminate duplicates Z: 15 55.564 2.362 1.623 0.941 0.929 0.714 CB 1.790 15 residues pruned to eliminate duplicates Z: 15 19.148 1.993 0.754 0.511 0.929 0.643 CA 1.560 15 residues pruned to eliminate duplicates Z: 28 27.487 2.130 0.645 0.637 0.889 0.667 CB 1.493 28 residues pruned to eliminate duplicates Z: 8 5.205 1.459 0.154 0.763 1.000 0.714 CB 0.925 8 residues pruned to eliminate duplicates Z: 6 3.725 1.895 0.085 0.529 0.800 0.400 CB 0.984 6 residues pruned to eliminate duplicates Z: 34 32.497 2.096 0.631 0.843 0.970 0.606 CB 1.271 34 residues pruned to eliminate duplicates Z: 18 24.928 1.996 0.433 0.914 1.000 0.824 CA 1.495 18 residues pruned to eliminate duplicates Z: 16 24.870 2.233 0.820 0.447 1.000 0.400 CB 1.669 16 residues pruned to eliminate duplicates Z: 15 24.437 2.103 0.363 0.947 1.000 1.000 CB 1.574 15 residues pruned to eliminate duplicates Z: 16 21.243 1.946 0.435 0.933 1.000 0.933 CB 1.371 16 residues pruned to eliminate duplicates Z: 8 10.463 1.780 0.533 0.868 1.000 0.429 CA 1.059 Z: 14 13.888 2.008 0.574 0.655 0.923 0.538 CA 1.143 14 residues pruned to eliminate duplicates Z: 32 30.854 2.303 0.803 0.430 0.903 0.484 CB 1.589 32 residues pruned to eliminate duplicates Z: 16 11.346 1.962 0.347 0.363 0.867 0.533 CB 1.482 16 residues pruned to eliminate duplicates Z: 18 34.827 2.033 0.904 0.927 1.000 0.765 CB 1.530 18 residues pruned to eliminate duplicates Z: 17 10.632 2.023 0.721 0.360 0.750 0.438 CB 1.183 17 residues pruned to eliminate duplicates Z: 21 18.520 2.022 0.631 0.464 0.900 0.650 CB 1.447 21 residues pruned to eliminate duplicates Z: 15 20.405 1.871 0.696 0.840 0.929 0.714 CB 1.382 15 residues pruned to eliminate duplicates Z: 9 3.124 1.666 0.479 0.302 0.500 0.375 C 1.119 9 residues pruned to eliminate duplicates Z: 21 35.090 2.270 0.554 0.905 1.000 0.800 CB 1.583 21 residues pruned to eliminate duplicates Z: 13 24.502 2.270 0.674 0.885 0.917 0.750 CB 1.466 13 residues pruned to eliminate duplicates Z: 20 33.412 2.295 0.591 0.881 0.947 0.684 CB 1.604 20 residues pruned to eliminate duplicates Z: 15 14.624 2.145 0.407 0.464 0.929 0.643 CB 1.447 15 residues pruned to eliminate duplicates Z: 48 32.962 2.046 0.833 0.572 0.915 0.553 CB 1.308 34 residues pruned to eliminate duplicates Z: 16 19.202 2.231 0.775 0.301 0.933 0.400 CB 1.673 16 residues pruned to eliminate duplicates Z: 80 38.905 2.070 0.686 0.537 0.899 0.658 CB 1.346 80 residues pruned to eliminate duplicates Z: 8 5.307 1.680 -0.128 0.605 1.000 0.571 CB 1.239 6 residues pruned to eliminate duplicates Z: 91 48.174 2.119 0.703 0.552 0.933 0.656 CB 1.434 92 residues pruned to eliminate duplicates Z: 8 6.700 1.767 -0.106 0.707 1.000 0.571 CB 1.328 Z: 15 20.499 1.718 0.809 0.873 1.000 0.714 CA 1.284 15 residues pruned to eliminate duplicates Z: 21 13.294 1.948 0.591 0.428 0.800 0.700 CB 1.293 21 residues pruned to eliminate duplicates Z: 118 56.697 2.186 0.896 0.496 0.846 0.607 CB 1.500 211 residues pruned to eliminate duplicates Z: 17 14.952 2.103 0.613 0.536 0.812 0.750 CB 1.309 17 residues pruned to eliminate duplicates Z: 16 21.074 2.213 0.636 0.769 0.800 0.333 CB 1.480 Z: 53 24.529 1.955 0.611 0.549 0.846 0.577 CB 1.216 7 residues pruned to eliminate duplicates Z: 26 28.292 2.090 0.678 0.681 0.960 0.720 CB 1.423 26 residues pruned to eliminate duplicates Z: 16 20.296 2.147 0.601 0.761 0.867 0.733 CB 1.394 16 residues pruned to eliminate duplicates Z: 18 23.742 1.956 0.363 0.925 1.000 0.882 CB 1.515 18 residues pruned to eliminate duplicates Z: 12 10.485 1.922 0.577 0.309 1.000 0.818 CB 1.289 12 residues pruned to eliminate duplicates Z: 15 15.289 1.883 0.755 0.525 0.929 0.643 CB 1.300 15 residues pruned to eliminate duplicates Z: 19 35.291 1.988 0.959 0.927 1.000 0.833 CB 1.498 19 residues pruned to eliminate duplicates Z: 13 17.609 1.902 0.340 0.894 1.000 0.750 CA 1.431 13 residues pruned to eliminate duplicates Z: 17 11.805 1.756 0.524 0.491 0.938 0.625 CB 1.186 17 residues pruned to eliminate duplicates Z: 12 18.615 2.159 0.683 0.502 0.909 0.727 CB 1.695 12 residues pruned to eliminate duplicates Z: 6 2.783 1.805 -0.192 0.652 0.800 0.800 CB 0.926 Z: 21 28.118 2.400 0.834 0.389 0.900 0.550 CB 1.785 21 residues pruned to eliminate duplicates Z: 6 8.781 2.004 0.546 0.403 1.000 0.800 CB 1.404 6 residues pruned to eliminate duplicates Z: 7 7.596 1.804 -0.110 0.792 1.000 0.833 CB 1.496 7 residues pruned to eliminate duplicates Z: 22 24.142 2.007 0.740 0.672 1.000 0.714 CB 1.287 22 residues pruned to eliminate duplicates Z: 9 18.931 2.095 0.775 0.861 0.875 0.625 CB 1.511 9 residues pruned to eliminate duplicates Z: 6 11.696 2.002 0.364 0.836 1.000 0.600 CA 1.434 Z: 54 42.979 2.265 0.692 0.587 0.925 0.585 CB 1.533 54 residues pruned to eliminate duplicates Z: 6 9.053 1.751 0.687 0.875 1.000 1.000 CB 0.997 Z: 17 29.354 2.015 0.903 0.897 0.938 0.625 CB 1.461 17 residues pruned to eliminate duplicates Z: 15 28.561 2.275 0.753 0.840 1.000 0.643 CB 1.429 Z: 17 27.049 2.150 0.801 0.775 0.938 0.562 CA 1.461 16 residues pruned to eliminate duplicates Z: 16 11.915 1.777 0.108 0.928 1.000 0.667 CB 1.094 Z: 35 37.013 2.337 0.627 0.591 0.912 0.706 CB 1.678 37 residues pruned to eliminate duplicates Z: 14 13.415 1.857 0.661 0.655 0.769 0.615 CB 1.358 13 residues pruned to eliminate duplicates Z: 16 28.086 2.249 0.638 0.803 1.000 0.600 CB 1.511 15 residues pruned to eliminate duplicates Z: 14 53.483 2.425 1.354 0.924 1.000 0.923 CA 1.825 14 residues pruned to eliminate duplicates Z: 16 25.892 1.975 0.804 0.913 1.000 0.800 CB 1.327 16 residues pruned to eliminate duplicates Z: 21 38.838 2.315 0.642 0.895 1.000 0.800 CB 1.637 21 residues pruned to eliminate duplicates Z: 27 20.068 1.972 0.626 0.525 0.885 0.654 CB 1.354 27 residues pruned to eliminate duplicates Z: 15 31.265 2.441 0.871 0.849 0.857 0.714 CB 1.582 15 residues pruned to eliminate duplicates Z: 22 34.112 2.441 0.834 0.457 0.905 0.476 CA 1.921 22 residues pruned to eliminate duplicates Z: 28 22.081 2.008 0.848 0.521 0.889 0.667 CB 1.261 28 residues pruned to eliminate duplicates Z: 22 21.700 1.957 0.649 0.508 0.952 0.571 CA 1.529 22 residues pruned to eliminate duplicates Z: 15 20.441 2.048 0.642 0.518 1.000 0.714 CB 1.596 15 residues pruned to eliminate duplicates Z: 10 5.627 1.639 0.391 0.786 1.000 0.778 CB 0.640 10 residues pruned to eliminate duplicates Z: 30 19.190 1.823 0.799 0.582 0.931 0.655 CB 1.079 23 residues pruned to eliminate duplicates Z: 13 18.850 1.953 0.475 0.841 1.000 0.750 CB 1.408 13 residues pruned to eliminate duplicates Z: 37 50.894 2.355 0.670 0.854 0.972 0.667 CB 1.638 37 residues pruned to eliminate duplicates Z: 39 47.824 2.303 0.579 0.863 0.947 0.658 CB 1.652 39 residues pruned to eliminate duplicates Z: 12 3.792 1.594 0.252 0.526 0.727 0.636 CB 0.768 11 residues pruned to eliminate duplicates Z: 24 28.033 2.024 0.922 0.628 0.957 0.783 CB 1.393 24 residues pruned to eliminate duplicates Z: 12 22.090 2.052 0.841 0.814 0.909 0.727 CA 1.476 12 residues pruned to eliminate duplicates Z: 7 6.674 1.958 0.294 0.420 0.833 0.667 CA 1.404 7 residues pruned to eliminate duplicates Z: 11 14.343 1.954 0.905 0.745 1.000 0.900 CB 0.978 11 residues pruned to eliminate duplicates Z: 21 35.499 2.219 0.611 0.912 1.000 0.800 CB 1.572 21 residues pruned to eliminate duplicates Z: 16 14.991 1.915 0.727 0.439 0.933 0.733 CA 1.336 10 residues pruned to eliminate duplicates Z: 15 12.831 1.822 0.290 0.918 1.000 0.786 CB 1.030 16 residues pruned to eliminate duplicates Z: 61 48.589 2.142 0.812 0.624 0.933 0.683 CB 1.541 61 residues pruned to eliminate duplicates Z: 31 24.237 1.953 0.812 0.601 0.933 0.567 CB 1.217 37 residues pruned to eliminate duplicates Z: 37 27.527 2.070 0.840 0.547 0.889 0.500 CB 1.294 37 residues pruned to eliminate duplicates Z: 7 3.976 1.229 0.699 0.654 1.000 0.667 CB 0.674 7 residues pruned to eliminate duplicates Z: 34 33.121 2.195 0.716 0.510 0.909 0.606 CB 1.667 34 residues pruned to eliminate duplicates Z: 15 19.990 1.893 0.627 0.797 0.929 0.643 CA 1.441 15 residues pruned to eliminate duplicates Z: 13 30.326 2.269 0.757 0.908 1.000 0.917 CB 1.559 13 residues pruned to eliminate duplicates Z: 32 27.818 2.119 0.805 0.437 0.935 0.548 CB 1.491 32 residues pruned to eliminate duplicates Z: 14 23.563 1.988 0.864 0.813 0.923 0.692 CB 1.455 14 residues pruned to eliminate duplicates Z: 11 26.610 2.267 0.605 0.905 1.000 0.900 CA 1.646 11 residues pruned to eliminate duplicates Z: 36 26.493 1.999 0.909 0.596 0.857 0.543 CB 1.249 36 residues pruned to eliminate duplicates Z: 26 18.957 2.008 0.785 0.527 0.840 0.680 CB 1.227 26 residues pruned to eliminate duplicates Z: 13 33.480 2.236 0.915 0.855 0.917 0.750 CA 1.816 13 residues pruned to eliminate duplicates Z: 40 26.853 2.036 0.715 0.585 0.846 0.590 CB 1.341 40 residues pruned to eliminate duplicates Z: 20 44.524 2.329 1.133 0.914 0.947 0.684 CB 1.535 20 residues pruned to eliminate duplicates Z: 14 27.508 2.002 0.873 0.838 1.000 0.769 CA 1.520 14 residues pruned to eliminate duplicates Z: 12 16.880 2.241 0.731 0.430 0.909 0.818 CB 1.552 12 residues pruned to eliminate duplicates Z: 12 11.475 2.023 0.480 0.481 0.909 0.818 CB 1.296 12 residues pruned to eliminate duplicates Z: 75 52.437 2.237 0.863 0.576 0.905 0.595 CB 1.502 143 residues pruned to eliminate duplicates Z: 7 9.872 2.001 0.569 0.250 1.000 0.500 CB 1.713 7 residues pruned to eliminate duplicates Z: 18 37.099 2.450 0.951 0.515 1.000 0.412 CB 1.856 18 residues pruned to eliminate duplicates Z: 18 30.712 1.976 0.755 0.932 1.000 0.882 CB 1.501 18 residues pruned to eliminate duplicates Z: 94 52.717 2.160 0.799 0.563 0.914 0.613 CB 1.448 17 residues pruned to eliminate duplicates Z: 9 3.789 1.656 -0.064 0.550 0.750 0.500 CB 1.097 Z: 16 13.409 1.871 0.692 0.524 0.867 0.600 CB 1.233 16 residues pruned to eliminate duplicates Z: 20 23.583 2.097 0.687 0.511 0.947 0.684 CB 1.597 20 residues pruned to eliminate duplicates Z: 42 32.156 2.027 0.783 0.585 0.878 0.659 CB 1.459 42 residues pruned to eliminate duplicates Z: 14 19.960 2.062 0.616 0.832 0.846 0.615 CB 1.474 14 residues pruned to eliminate duplicates Z: 10 16.253 2.040 0.548 0.554 1.000 0.889 CA 1.628 10 residues pruned to eliminate duplicates Z: 11 10.932 1.789 0.553 0.706 0.900 0.600 CA 1.146 11 residues pruned to eliminate duplicates Z: 13 57.993 2.590 1.458 0.920 1.000 1.000 CB 1.851 13 residues pruned to eliminate duplicates Z: 6 4.986 2.005 0.517 0.293 0.800 0.400 CA 1.155 6 residues pruned to eliminate duplicates Z: 8 12.328 1.813 0.524 0.890 1.000 0.714 CA 1.212 8 residues pruned to eliminate duplicates Z: 19 29.368 1.960 0.637 0.932 1.000 0.889 CA 1.506 19 residues pruned to eliminate duplicates Z: 19 25.170 1.999 0.566 0.885 1.000 0.778 CB 1.369 19 residues pruned to eliminate duplicates Z: 15 13.747 2.047 0.558 0.395 0.857 0.571 CA 1.502 15 residues pruned to eliminate duplicates Z: 37 32.732 2.061 0.536 0.840 0.944 0.722 CB 1.362 37 residues pruned to eliminate duplicates Z: 78 52.697 2.200 0.842 0.549 0.948 0.636 CB 1.489 78 residues pruned to eliminate duplicates Z: 14 19.060 1.977 0.586 0.885 0.923 0.846 CA 1.318 14 residues pruned to eliminate duplicates Z: 8 17.745 1.888 0.967 0.754 1.000 0.714 CB 1.440 8 residues pruned to eliminate duplicates Z: 28 25.392 1.951 0.714 0.701 0.889 0.593 CB 1.369 47 residues pruned to eliminate duplicates Z: 17 37.514 2.426 0.827 0.830 0.938 0.625 CB 1.698 17 residues pruned to eliminate duplicates Z: 22 14.878 2.007 0.670 0.542 0.810 0.667 CB 1.149 22 residues pruned to eliminate duplicates Z: 7 9.882 2.079 1.183 0.389 0.667 0.667 CA 1.501 7 residues pruned to eliminate duplicates Z: 7 7.957 1.695 0.223 0.876 1.000 1.000 CB 1.139 7 residues pruned to eliminate duplicates Z: 15 16.458 1.846 0.471 0.925 1.000 0.857 CB 1.137 15 residues pruned to eliminate duplicates Z: 15 20.059 1.883 0.583 0.785 1.000 0.357 CA 1.399 15 residues pruned to eliminate duplicates Z: 16 11.297 1.786 0.030 0.917 1.000 0.933 CB 1.119 16 residues pruned to eliminate duplicates Z: 14 31.190 2.312 0.767 0.816 1.000 0.538 CB 1.608 14 residues pruned to eliminate duplicates Z: 24 26.024 2.071 0.847 0.538 0.957 0.652 CB 1.428 24 residues pruned to eliminate duplicates Z: 14 44.447 2.347 1.373 0.904 0.923 0.923 CA 1.708 14 residues pruned to eliminate duplicates Z: 18 25.529 1.940 0.663 0.892 0.941 0.529 CB 1.465 18 residues pruned to eliminate duplicates Z: 6 3.297 1.699 0.496 0.556 0.600 0.400 CA 0.916 6 residues pruned to eliminate duplicates Z: 45 34.716 2.076 0.807 0.545 0.977 0.682 CB 1.366 44 residues pruned to eliminate duplicates Z: 16 13.877 1.801 0.212 0.925 1.000 0.933 CB 1.152 16 residues pruned to eliminate duplicates Z: 8 3.318 1.491 0.315 0.284 0.714 0.429 N 1.142 Z: 17 35.139 2.010 0.985 0.950 1.000 0.750 CB 1.519 17 residues pruned to eliminate duplicates Z: 15 20.368 2.076 0.661 0.503 1.000 0.857 CB 1.575 15 residues pruned to eliminate duplicates Z: 89 60.184 2.287 0.736 0.603 0.943 0.625 CB 1.553 89 residues pruned to eliminate duplicates Z: 8 8.825 1.722 0.427 0.897 0.857 0.857 CA 1.133 8 residues pruned to eliminate duplicates Z: 12 21.505 1.915 0.827 0.829 1.000 0.545 CB 1.394 12 residues pruned to eliminate duplicates Z: 12 17.901 2.021 0.404 0.853 1.000 0.909 CB 1.407 12 residues pruned to eliminate duplicates Z: 12 6.801 1.650 0.587 0.459 0.909 0.545 CB 0.898 Z: 6 3.836 1.663 -0.163 0.645 0.800 0.800 CB 1.345 6 residues pruned to eliminate duplicates Z: 37 26.886 2.154 0.509 0.618 0.861 0.722 CB 1.432 37 residues pruned to eliminate duplicates Z: 13 25.652 1.999 0.806 0.837 1.000 0.583 CB 1.534 13 residues pruned to eliminate duplicates Z: 18 24.295 1.919 0.549 0.912 1.000 0.765 CB 1.404 18 residues pruned to eliminate duplicates Z: 7 3.191 1.323 -0.008 0.744 0.833 0.500 CB 0.957 7 residues pruned to eliminate duplicates Z: 38 27.447 2.202 0.647 0.476 0.811 0.459 CB 1.573 38 residues pruned to eliminate duplicates Z: 21 38.436 2.184 1.203 0.906 0.850 0.550 CB 1.495 21 residues pruned to eliminate duplicates Z: 11 18.906 2.010 0.503 0.905 0.900 0.900 CA 1.565 11 residues pruned to eliminate duplicates Z: 25 22.445 2.049 0.766 0.541 0.875 0.667 CB 1.390 25 residues pruned to eliminate duplicates Z: 16 16.545 1.862 0.543 0.796 0.867 0.733 CB 1.323 16 residues pruned to eliminate duplicates Z: 14 23.130 2.069 0.476 0.899 1.000 0.846 CB 1.501 14 residues pruned to eliminate duplicates Z: 27 45.147 2.387 1.043 0.622 0.923 0.769 CB 1.753 27 residues pruned to eliminate duplicates Z: 14 20.265 2.015 0.432 0.822 1.000 0.538 CA 1.473 14 residues pruned to eliminate duplicates Z: 16 20.307 2.021 1.073 0.469 0.867 0.667 CB 1.490 16 residues pruned to eliminate duplicates Z: 13 17.310 2.192 0.789 0.358 0.917 0.667 CB 1.621 13 residues pruned to eliminate duplicates Z: 35 39.464 2.346 0.808 0.516 0.941 0.500 CB 1.669 36 residues pruned to eliminate duplicates Z: 30 28.073 1.962 1.021 0.560 0.966 0.586 CB 1.285 30 residues pruned to eliminate duplicates Z: 6 3.718 1.844 -0.074 0.419 1.000 0.800 CB 1.059 4 residues pruned to eliminate duplicates Z: 71 48.709 2.212 0.835 0.579 0.914 0.543 CB 1.453 71 residues pruned to eliminate duplicates Z: 33 28.431 2.055 0.668 0.691 0.938 0.656 CB 1.313 33 residues pruned to eliminate duplicates Z: 10 15.839 2.141 0.604 0.884 1.000 0.889 CB 1.111 10 residues pruned to eliminate duplicates Z: 10 12.441 1.914 0.632 0.904 0.889 0.889 CB 1.064 10 residues pruned to eliminate duplicates Z: 7 7.352 1.734 0.941 0.564 0.833 0.667 CB 1.006 Z: 21 17.191 2.012 0.688 0.561 0.950 0.700 CB 1.123 21 residues pruned to eliminate duplicates Z: 49 26.600 1.977 0.713 0.531 0.896 0.542 CB 1.227 49 residues pruned to eliminate duplicates Z: 26 28.374 2.275 0.780 0.478 0.880 0.720 CA 1.629 26 residues pruned to eliminate duplicates Z: 11 14.175 1.935 0.432 0.753 1.000 0.700 CA 1.291 12 residues pruned to eliminate duplicates Z: 22 18.505 2.020 0.705 0.418 0.905 0.571 CB 1.412 22 residues pruned to eliminate duplicates Z: 23 27.665 2.209 0.535 0.708 0.955 0.545 CB 1.509 23 residues pruned to eliminate duplicates Z: 11 19.025 1.963 0.732 0.805 1.000 0.700 CB 1.356 11 residues pruned to eliminate duplicates Z: 15 35.796 2.324 0.869 0.895 1.000 0.786 CB 1.579 15 residues pruned to eliminate duplicates Z: 13 15.191 1.916 0.365 0.875 1.000 0.833 CB 1.220 14 residues pruned to eliminate duplicates Z: 14 22.671 2.021 0.753 0.823 0.923 0.692 CB 1.453 14 residues pruned to eliminate duplicates Z: 14 16.744 1.897 0.865 0.622 0.923 0.769 CB 1.267 8 residues pruned to eliminate duplicates Z: 47 34.684 2.138 0.728 0.473 0.935 0.522 CB 1.521 47 residues pruned to eliminate duplicates Z: 37 48.144 2.381 0.616 0.846 0.944 0.722 CB 1.640 37 residues pruned to eliminate duplicates Z: 19 29.279 1.957 0.659 0.935 1.000 0.833 CA 1.481 19 residues pruned to eliminate duplicates Z: 13 4.543 1.742 -0.109 0.361 0.917 0.333 CB 1.071 7 residues pruned to eliminate duplicates Z: 81 41.515 2.050 0.834 0.554 0.900 0.575 CB 1.301 78 residues pruned to eliminate duplicates Z: 24 37.661 2.398 0.754 0.622 0.913 0.565 CB 1.822 24 residues pruned to eliminate duplicates Z: 38 36.840 2.285 0.785 0.517 0.946 0.676 CB 1.544 132 residues pruned to eliminate duplicates Z: 13 19.455 1.959 0.971 0.546 0.917 0.667 CB 1.517 14 residues pruned to eliminate duplicates Z: 16 10.741 1.833 0.587 0.459 0.867 0.733 CB 1.146 16 residues pruned to eliminate duplicates Z: 14 18.060 2.082 0.809 0.388 1.000 0.692 CB 1.499 14 residues pruned to eliminate duplicates Z: 18 21.851 1.885 0.911 0.853 0.882 0.824 CB 1.232 18 residues pruned to eliminate duplicates Z: 22 12.036 1.904 0.632 0.513 0.857 0.524 CB 0.973 22 residues pruned to eliminate duplicates Z: 13 26.120 1.922 0.967 0.921 1.000 0.667 CB 1.404 13 residues pruned to eliminate duplicates Z: 34 35.532 2.399 0.665 0.490 0.879 0.455 CB 1.780 34 residues pruned to eliminate duplicates Z: 99 41.182 2.067 0.636 0.474 0.918 0.541 CB 1.376 99 residues pruned to eliminate duplicates Z: 18 20.499 1.890 0.261 0.920 1.000 0.824 CB 1.470 18 residues pruned to eliminate duplicates Z: 16 16.194 1.803 0.511 0.928 1.000 0.800 CB 1.075 15 residues pruned to eliminate duplicates Z: 30 33.423 2.402 0.708 0.474 0.931 0.483 CB 1.669 30 residues pruned to eliminate duplicates Z: 17 13.368 1.882 0.443 0.570 0.875 0.750 CB 1.315 Z: 28 32.575 2.338 0.575 0.619 0.926 0.593 CB 1.643 28 residues pruned to eliminate duplicates Z: 29 46.090 2.403 0.880 0.629 0.964 0.750 CB 1.771 29 residues pruned to eliminate duplicates Z: 16 15.401 1.830 0.342 0.936 1.000 0.867 CB 1.127 16 residues pruned to eliminate duplicates Z: 6 9.800 1.892 0.805 0.630 0.800 0.600 CB 1.420 6 residues pruned to eliminate duplicates Z: 6 4.463 1.913 -0.244 0.816 1.000 0.800 CB 1.049 7 residues pruned to eliminate duplicates Z: 8 5.164 2.042 0.247 0.265 0.714 0.286 CB 1.403 8 residues pruned to eliminate duplicates Z: 16 33.199 2.386 0.905 0.722 0.933 0.733 CB 1.654 16 residues pruned to eliminate duplicates Z: 15 11.075 1.799 0.052 0.933 1.000 0.929 CB 1.091 15 residues pruned to eliminate duplicates Z: 19 30.748 2.003 0.665 0.921 1.000 0.889 CB 1.530 19 residues pruned to eliminate duplicates Z: 72 41.552 2.037 0.842 0.590 0.901 0.549 CB 1.337 72 residues pruned to eliminate duplicates Z: 7 8.715 1.728 1.068 0.536 0.667 0.667 CA 1.442 Z: 8 4.017 1.845 0.003 0.701 0.857 0.857 CB 0.797 Z: 36 37.134 2.174 0.602 0.840 0.943 0.686 CB 1.426 36 residues pruned to eliminate duplicates Z: 16 8.726 1.760 0.351 0.507 1.000 0.667 CB 0.940 16 residues pruned to eliminate duplicates Z: 15 19.626 2.058 0.842 0.586 0.929 0.643 CB 1.372 15 residues pruned to eliminate duplicates Z: 34 34.076 2.085 0.772 0.640 0.939 0.758 CB 1.500 34 residues pruned to eliminate duplicates Z: 9 10.808 1.936 0.919 0.701 0.875 0.750 CB 0.979 9 residues pruned to eliminate duplicates Z: 20 26.707 2.425 0.580 0.462 0.895 0.474 CB 1.859 20 residues pruned to eliminate duplicates Z: 17 32.496 2.149 0.699 0.942 1.000 0.938 CB 1.543 17 residues pruned to eliminate duplicates 6 1.832 1.343 -0.006 0.310 0.800 0.400 CB 0.947 ? Z: 15 21.275 2.020 0.312 0.900 1.000 0.857 CB 1.533 15 residues pruned to eliminate duplicates Z: 22 43.917 2.436 0.898 0.650 1.000 0.762 CB 1.803 22 residues pruned to eliminate duplicates Z: 7 4.702 1.617 0.409 0.448 0.833 0.500 CB 1.067 Z: 7 4.409 1.691 0.152 0.331 0.833 0.333 N 1.334 8 residues pruned to eliminate duplicates Z: 16 9.422 1.943 0.658 0.202 0.733 0.400 CB 1.466 16 residues pruned to eliminate duplicates Z: 8 5.065 1.561 0.598 0.331 0.857 0.429 CB 1.077 Z: 22 26.772 1.942 0.809 0.847 0.952 0.810 CB 1.296 22 residues pruned to eliminate duplicates Z: 12 19.291 1.933 0.675 0.851 1.000 0.727 CB 1.330 12 residues pruned to eliminate duplicates Z: 13 12.708 1.999 0.251 0.514 1.000 0.667 CA 1.447 13 residues pruned to eliminate duplicates Z: 7 4.501 1.798 0.419 0.250 0.833 0.333 CB 1.153 7 residues pruned to eliminate duplicates Z: 25 24.417 2.070 0.783 0.570 0.917 0.667 CB 1.376 25 residues pruned to eliminate duplicates Z: 6 5.927 1.677 -0.007 0.648 1.000 0.400 CB 1.385 Z: 15 28.483 2.064 0.752 0.930 1.000 0.857 CB 1.472 15 residues pruned to eliminate duplicates Z: 25 24.255 2.028 0.819 0.578 0.917 0.750 CB 1.358 25 residues pruned to eliminate duplicates Z: 24 28.960 2.412 0.802 0.425 0.913 0.478 CB 1.645 24 residues pruned to eliminate duplicates Z: 27 52.255 2.443 0.989 0.680 0.923 0.769 CB 1.936 27 residues pruned to eliminate duplicates Z: 23 20.215 1.811 0.841 0.535 0.909 0.636 CB 1.375 13 residues pruned to eliminate duplicates Z: 38 32.985 2.264 0.607 0.559 0.919 0.622 CB 1.531 38 residues pruned to eliminate duplicates Z: 6 2.588 1.703 -0.182 0.409 0.800 0.800 CB 1.143 Z: 33 35.091 2.151 0.608 0.833 0.938 0.719 CB 1.436 33 residues pruned to eliminate duplicates Z: 6 4.415 1.707 0.183 0.754 0.800 0.600 CB 0.975 6 residues pruned to eliminate duplicates Z: 15 24.782 2.098 0.428 0.924 1.000 0.929 CB 1.552 15 residues pruned to eliminate duplicates Z: 26 41.970 2.405 0.774 0.811 0.920 0.640 CB 1.631 26 residues pruned to eliminate duplicates Z: 8 11.250 1.703 0.725 0.727 1.000 0.714 CB 1.180 8 residues pruned to eliminate duplicates Z: 14 8.506 1.811 -0.112 0.925 1.000 0.923 CB 1.030 14 residues pruned to eliminate duplicates Z: 12 20.448 1.970 0.969 0.761 0.909 0.545 CB 1.387 12 residues pruned to eliminate duplicates Z: 12 5.657 1.821 0.059 0.511 0.909 0.364 CB 0.962 8 residues pruned to eliminate duplicates Z: 16 10.801 1.753 0.031 0.931 1.000 0.933 CB 1.078 16 residues pruned to eliminate duplicates Z: 15 33.826 2.179 1.007 0.852 0.929 0.786 CA 1.646 Z: 7 3.570 1.667 0.440 0.639 0.833 0.667 CB 0.639 7 residues pruned to eliminate duplicates Z: 14 15.641 2.051 0.663 0.379 1.000 0.692 CB 1.447 14 residues pruned to eliminate duplicates Z: 58 49.929 2.220 0.967 0.591 0.877 0.579 CB 1.583 58 residues pruned to eliminate duplicates Z: 25 21.772 2.045 0.758 0.561 0.833 0.708 CB 1.398 25 residues pruned to eliminate duplicates Z: 12 18.840 2.012 0.677 0.555 1.000 0.909 CA 1.596 12 residues pruned to eliminate duplicates Z: 23 23.323 2.230 0.523 0.492 0.864 0.591 CB 1.708 23 residues pruned to eliminate duplicates Z: 89 45.285 2.003 0.941 0.555 0.920 0.534 CB 1.279 89 residues pruned to eliminate duplicates Z: 34 44.939 2.200 0.751 0.872 0.970 0.697 CB 1.527 34 residues pruned to eliminate duplicates Z: 10 8.410 1.893 1.016 0.478 0.778 0.667 CB 0.966 10 residues pruned to eliminate duplicates Z: 7 6.257 1.456 0.377 0.691 1.000 1.000 CB 1.070 Z: 17 25.550 2.041 0.390 0.931 1.000 0.875 CB 1.573 17 residues pruned to eliminate duplicates Z: 48 40.097 2.145 0.666 0.708 0.979 0.660 CB 1.384 48 residues pruned to eliminate duplicates Z: 34 33.504 2.186 0.445 0.850 0.939 0.818 CB 1.456 34 residues pruned to eliminate duplicates Z: 12 10.632 1.953 0.712 0.452 0.909 0.545 CB 1.109 Z: 21 34.390 2.270 0.669 0.903 0.950 0.800 CB 1.523 21 residues pruned to eliminate duplicates Z: 34 19.515 2.168 0.582 0.345 0.879 0.364 CB 1.334 34 residues pruned to eliminate duplicates Z: 16 27.791 2.312 0.686 0.657 0.867 0.467 CA 1.835 16 residues pruned to eliminate duplicates Z: 26 20.764 1.840 0.518 0.741 0.960 0.680 CB 1.248 26 residues pruned to eliminate duplicates Z: 19 18.288 2.248 0.489 0.351 0.833 0.444 CA 1.815 19 residues pruned to eliminate duplicates Z: 12 17.830 1.910 0.762 0.880 0.909 0.727 CB 1.273 12 residues pruned to eliminate duplicates Z: 51 35.269 2.149 0.783 0.559 0.900 0.580 CB 1.366 12 residues pruned to eliminate duplicates Z: 73 56.987 2.300 0.671 0.672 0.958 0.667 CB 1.556 73 residues pruned to eliminate duplicates Z: 9 17.941 2.380 0.510 0.668 0.875 0.750 CB 1.726 9 residues pruned to eliminate duplicates Z: 13 17.678 1.896 0.663 0.812 0.917 0.667 CB 1.346 13 residues pruned to eliminate duplicates Z: 12 5.478 1.831 0.658 0.203 0.727 0.364 CB 1.064 12 residues pruned to eliminate duplicates Z: 12 12.081 1.813 0.625 0.529 0.909 0.545 CB 1.322 Z: 18 13.888 2.104 0.798 0.392 0.706 0.471 CB 1.414 18 residues pruned to eliminate duplicates Z: 33 26.712 2.187 0.514 0.555 0.906 0.656 CB 1.492 33 residues pruned to eliminate duplicates Z: 16 14.457 2.046 0.504 0.633 0.867 0.667 N 1.235 16 residues pruned to eliminate duplicates Z: 17 25.780 2.023 0.494 0.922 1.000 0.938 CB 1.500 17 residues pruned to eliminate duplicates Z: 50 34.591 2.206 0.696 0.491 0.898 0.612 CB 1.485 50 residues pruned to eliminate duplicates Z: 27 21.049 1.893 0.614 0.680 0.923 0.500 CB 1.240 27 residues pruned to eliminate duplicates Z: 35 25.418 1.937 0.812 0.590 0.941 0.647 CB 1.211 29 residues pruned to eliminate duplicates Z: 6 3.044 1.688 0.213 0.386 0.800 0.800 CB 0.938 4 residues pruned to eliminate duplicates Z: 18 8.764 1.787 0.579 0.315 0.706 0.353 CB 1.310 18 residues pruned to eliminate duplicates Z: 18 25.814 1.970 0.568 0.911 1.000 0.765 CB 1.436 18 residues pruned to eliminate duplicates Z: 21 42.032 2.254 0.785 0.928 1.000 0.750 CB 1.636 21 residues pruned to eliminate duplicates Z: 13 6.335 1.848 0.611 0.209 0.667 0.250 CA 1.299 13 residues pruned to eliminate duplicates Z: 55 44.192 2.255 0.501 0.655 0.981 0.722 CB 1.568 76 residues pruned to eliminate duplicates Z: 17 14.204 1.852 0.703 0.490 0.875 0.500 CB 1.301 17 residues pruned to eliminate duplicates Z: 14 10.123 1.833 -0.037 0.886 1.000 0.692 CB 1.148 14 residues pruned to eliminate duplicates Z: 29 23.002 2.078 0.620 0.564 0.857 0.607 CB 1.415 44 residues pruned to eliminate duplicates Z: 6 2.667 1.680 0.474 0.320 0.600 0.600 CB 0.980 6 1.957 1.426 0.651 0.344 0.600 0.400 CB 0.734 ? Z: 23 14.621 2.064 0.620 0.356 0.818 0.409 CB 1.331 23 residues pruned to eliminate duplicates 7 1.667 1.574 -0.238 0.423 0.833 0.333 CB 0.738 ? Z: 37 27.388 2.036 0.555 0.569 0.917 0.583 CB 1.471 37 residues pruned to eliminate duplicates Z: 6 8.790 1.923 0.412 0.635 1.000 0.800 CA 1.276 6 residues pruned to eliminate duplicates Z: 26 26.942 2.032 0.954 0.573 0.960 0.720 CB 1.317 26 residues pruned to eliminate duplicates Z: 7 6.216 1.617 0.209 0.652 1.000 0.667 N 1.127 Z: 95 52.796 2.259 0.812 0.489 0.872 0.479 CB 1.543 169 residues pruned to eliminate duplicates Z: 14 12.019 2.029 0.494 0.337 0.923 0.385 CA 1.424 14 residues pruned to eliminate duplicates Z: 58 37.938 2.151 0.648 0.570 0.895 0.614 CB 1.481 58 residues pruned to eliminate duplicates Z: 7 5.046 1.621 0.566 0.777 0.833 0.667 CB 0.763 8 residues pruned to eliminate duplicates Z: 17 10.066 1.952 0.415 0.332 0.812 0.625 CB 1.348 17 residues pruned to eliminate duplicates Z: 27 21.357 2.203 0.604 0.423 0.885 0.615 CB 1.452 27 residues pruned to eliminate duplicates Z: 12 16.001 2.006 0.638 0.783 0.818 0.636 CB 1.399 12 residues pruned to eliminate duplicates Z: 17 20.424 2.068 0.636 0.757 0.875 0.625 CB 1.372 17 residues pruned to eliminate duplicates Z: 14 13.385 1.926 0.480 0.484 1.000 0.769 CB 1.324 11 residues pruned to eliminate duplicates Z: 8 5.144 1.808 0.030 0.439 0.857 0.429 CB 1.296 8 residues pruned to eliminate duplicates Z: 116 54.517 2.168 0.783 0.524 0.887 0.574 CB 1.448 116 residues pruned to eliminate duplicates Z: 15 14.412 1.777 1.128 0.413 0.857 0.571 CB 1.302 15 residues pruned to eliminate duplicates Z: 33 29.198 2.036 0.722 0.673 1.000 0.656 CB 1.255 33 residues pruned to eliminate duplicates Z: 38 23.639 1.924 0.566 0.625 0.919 0.730 CB 1.248 Z: 33 35.010 2.224 0.829 0.566 0.938 0.562 CB 1.523 Z: 22 17.927 1.977 0.628 0.603 0.905 0.714 CB 1.217 22 residues pruned to eliminate duplicates Z: 32 31.288 2.282 0.707 0.433 0.903 0.484 CB 1.711 32 residues pruned to eliminate duplicates Z: 67 58.129 2.236 0.987 0.608 0.924 0.621 CB 1.573 71 residues pruned to eliminate duplicates Z: 20 22.486 1.891 0.876 0.588 1.000 0.632 CB 1.336 14 residues pruned to eliminate duplicates Z: 10 5.558 1.792 0.307 0.563 0.889 0.667 CB 0.837 Z: 19 25.398 1.987 0.423 0.935 1.000 0.944 CA 1.476 19 residues pruned to eliminate duplicates Z: 25 12.780 1.779 0.499 0.524 0.875 0.583 CB 1.092 25 residues pruned to eliminate duplicates Z: 8 11.227 2.027 0.223 0.684 1.000 0.714 CB 1.446 8 residues pruned to eliminate duplicates Z: 13 15.094 1.940 0.931 0.838 0.917 0.583 CB 0.948 13 residues pruned to eliminate duplicates Z: 6 2.125 1.440 0.399 0.280 0.800 0.400 N 0.756 Z: 12 22.941 2.137 0.900 0.559 1.000 0.727 CB 1.608 12 residues pruned to eliminate duplicates Z: 36 42.398 2.206 0.882 0.705 0.943 0.686 CB 1.519 12 residues pruned to eliminate duplicates Z: 52 38.479 2.246 0.661 0.591 0.922 0.706 CB 1.437 52 residues pruned to eliminate duplicates Z: 6 3.425 1.880 0.723 0.409 0.600 0.400 CB 0.867 Z: 18 14.107 1.914 0.147 0.820 1.000 0.647 CB 1.181 18 residues pruned to eliminate duplicates Z: 15 33.380 2.190 0.821 0.850 1.000 0.643 CA 1.656 19 residues pruned to eliminate duplicates Z: 16 32.157 2.268 0.743 0.786 1.000 0.533 CB 1.634 18 residues pruned to eliminate duplicates Z: 17 23.227 1.971 0.425 0.941 1.000 1.000 CB 1.435 17 residues pruned to eliminate duplicates Z: 8 2.887 1.533 0.498 0.472 0.571 0.571 CB 0.855 Z: 29 21.130 2.061 0.348 0.642 0.929 0.679 CB 1.355 29 residues pruned to eliminate duplicates Z: 7 3.447 1.641 0.296 0.343 0.833 0.667 CA 0.942 Z: 22 26.664 2.200 0.691 0.519 0.857 0.571 CA 1.791 22 residues pruned to eliminate duplicates Z: 20 19.361 2.251 0.701 0.422 0.789 0.474 CB 1.595 49 residues pruned to eliminate duplicates Z: 23 19.765 1.830 0.734 0.509 0.955 0.682 CA 1.379 23 residues pruned to eliminate duplicates Z: 35 32.884 2.155 0.454 0.848 0.941 0.735 CB 1.419 35 residues pruned to eliminate duplicates Z: 21 30.414 2.290 0.833 0.633 0.850 0.700 CB 1.681 21 residues pruned to eliminate duplicates Z: 38 49.444 2.324 0.672 0.868 0.946 0.811 CB 1.616 38 residues pruned to eliminate duplicates Z: 23 22.050 1.887 0.899 0.669 0.864 0.500 CB 1.299 23 residues pruned to eliminate duplicates Z: 26 31.467 2.320 0.523 0.561 1.000 0.680 CA 1.679 26 residues pruned to eliminate duplicates Z: 8 22.299 2.352 0.446 0.899 1.000 0.857 CB 1.771 8 residues pruned to eliminate duplicates Z: 21 11.627 1.992 0.299 0.421 0.800 0.400 CB 1.364 21 residues pruned to eliminate duplicates Z: 16 25.265 2.115 0.450 0.921 1.000 1.000 CB 1.498 16 residues pruned to eliminate duplicates Z: 31 16.287 1.761 0.674 0.492 0.933 0.633 CB 1.090 29 residues pruned to eliminate duplicates Z: 26 20.375 2.023 0.735 0.487 0.880 0.600 CB 1.336 26 residues pruned to eliminate duplicates Z: 14 18.614 1.742 0.945 0.883 1.000 0.692 CB 1.102 14 residues pruned to eliminate duplicates Z: 37 28.346 2.042 0.592 0.613 1.000 0.639 CB 1.306 37 residues pruned to eliminate duplicates Z: 16 21.928 2.078 0.560 0.898 0.933 0.533 CB 1.339 16 residues pruned to eliminate duplicates Z: 17 23.702 2.028 0.536 0.884 0.875 0.750 CB 1.572 17 residues pruned to eliminate duplicates Z: 65 38.547 2.149 0.602 0.600 0.906 0.750 CB 1.404 65 residues pruned to eliminate duplicates Z: 6 2.619 1.614 0.854 0.419 0.600 0.400 CB 0.710 7 1.347 1.285 0.226 0.248 0.667 0.333 CB 0.700 ? Z: 18 36.112 2.050 0.924 0.930 1.000 0.706 CB 1.553 18 residues pruned to eliminate duplicates Z: 25 18.506 2.024 0.618 0.532 0.792 0.458 CA 1.412 25 residues pruned to eliminate duplicates Z: 16 28.049 2.087 0.600 0.947 1.000 0.467 CB 1.499 16 residues pruned to eliminate duplicates Z: 27 28.956 2.251 0.822 0.534 0.885 0.577 CB 1.513 21 residues pruned to eliminate duplicates Z: 25 20.601 2.087 0.627 0.402 0.875 0.500 CB 1.570 25 residues pruned to eliminate duplicates Z: 17 11.851 1.850 0.857 0.251 0.812 0.562 CB 1.412 17 residues pruned to eliminate duplicates Z: 17 28.856 2.139 0.764 0.798 0.938 0.625 CB 1.571 17 residues pruned to eliminate duplicates Z: 56 28.275 2.144 0.648 0.460 0.836 0.545 CB 1.344 192 residues pruned to eliminate duplicates Z: 7 2.169 1.377 -0.039 0.383 0.833 0.167 CB 0.909 Z: 16 53.861 2.325 1.251 0.930 1.000 0.867 CB 1.858 16 residues pruned to eliminate duplicates Z: 14 42.382 2.425 1.027 0.928 1.000 0.923 CB 1.674 14 residues pruned to eliminate duplicates Z: 66 41.409 2.128 0.794 0.536 0.908 0.538 CB 1.430 57 residues pruned to eliminate duplicates Z: 12 12.744 2.082 0.721 0.521 0.818 0.545 CA 1.284 Z: 15 19.391 2.017 0.407 0.833 1.000 0.643 CB 1.370 15 residues pruned to eliminate duplicates Z: 15 19.264 2.087 0.693 0.505 0.929 0.857 CB 1.561 15 residues pruned to eliminate duplicates Z: 7 2.075 1.800 -0.042 0.504 0.667 0.500 CB 0.735 7 residues pruned to eliminate duplicates Z: 14 22.027 2.121 0.888 0.454 1.000 0.692 CB 1.599 14 residues pruned to eliminate duplicates Z: 16 35.451 2.173 1.115 0.701 1.000 0.667 CB 1.657 16 residues pruned to eliminate duplicates Z: 12 9.852 1.969 0.324 0.368 0.909 0.727 CA 1.445 12 residues pruned to eliminate duplicates Z: 11 11.389 1.943 0.356 0.529 1.000 0.500 CA 1.328 11 residues pruned to eliminate duplicates Z: 21 19.153 2.028 0.668 0.466 0.900 0.750 CB 1.456 21 residues pruned to eliminate duplicates Z: 6 2.347 1.438 0.066 0.383 0.800 0.600 CB 0.970 Z: 18 12.074 1.887 0.680 0.499 0.765 0.588 CB 1.209 18 residues pruned to eliminate duplicates Z: 20 27.358 1.862 1.044 0.881 0.947 0.579 CB 1.260 20 residues pruned to eliminate duplicates Z: 20 24.056 2.129 0.613 0.504 1.000 0.632 CB 1.602 20 residues pruned to eliminate duplicates Z: 58 44.309 2.336 0.525 0.595 0.947 0.702 CB 1.588 58 residues pruned to eliminate duplicates Z: 8 3.888 1.508 0.289 0.623 0.857 0.714 CB 0.785 8 residues pruned to eliminate duplicates Z: 23 24.622 2.240 0.568 0.601 0.864 0.818 CA 1.572 23 residues pruned to eliminate duplicates Z: 6 2.243 1.681 -0.164 0.267 0.800 0.400 CB 1.164 Z: 6 3.977 1.410 0.828 0.753 0.800 0.800 CB 0.689 Z: 28 17.109 1.932 0.434 0.412 0.926 0.593 CB 1.408 28 residues pruned to eliminate duplicates Z: 36 35.778 2.160 0.596 0.834 0.914 0.771 CB 1.437 36 residues pruned to eliminate duplicates Z: 8 4.387 1.514 0.307 0.674 0.857 0.714 CB 0.833 Z: 7 11.556 1.972 0.391 0.711 1.000 0.833 CB 1.420 7 residues pruned to eliminate duplicates Z: 13 25.348 1.944 0.887 0.871 1.000 0.667 CB 1.455 Z: 32 30.089 2.007 0.858 0.653 1.000 0.710 CB 1.257 Z: 18 17.627 1.920 0.733 0.673 0.941 0.706 CB 1.163 18 residues pruned to eliminate duplicates Z: 114 51.591 2.155 0.718 0.526 0.903 0.619 CB 1.416 114 residues pruned to eliminate duplicates Z: 21 44.964 2.387 0.791 0.886 0.950 0.700 CB 1.786 21 residues pruned to eliminate duplicates Z: 15 48.178 2.376 1.146 0.939 1.000 0.857 CB 1.755 15 residues pruned to eliminate duplicates Z: 9 11.525 2.027 0.597 0.563 0.875 0.750 CB 1.353 Z: 32 36.392 2.245 0.861 0.588 0.871 0.742 CB 1.651 32 residues pruned to eliminate duplicates Z: 21 30.721 2.216 0.814 0.783 0.950 0.850 CB 1.402 21 residues pruned to eliminate duplicates Z: 18 23.833 1.934 0.493 0.884 1.000 0.765 CB 1.447 18 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 28 22.053 1.996 0.864 0.515 0.889 0.630 CB 1.264 Z: 25 28.611 2.078 1.042 0.591 0.958 0.708 CB 1.317 28 residues pruned to eliminate duplicates Z: 24 24.957 1.953 1.018 0.597 0.870 0.696 CB 1.383 24 residues pruned to eliminate duplicates Z: 26 29.114 2.046 1.042 0.579 0.960 0.680 CB 1.346 25 residues pruned to eliminate duplicates Z: 27 22.925 2.031 0.696 0.512 1.000 0.731 CB 1.290 27 residues pruned to eliminate duplicates Z: 28 24.232 1.989 0.884 0.516 0.926 0.704 CB 1.323 28 residues pruned to eliminate duplicates Z: 25 30.259 2.094 1.000 0.586 0.958 0.750 CB 1.416 25 residues pruned to eliminate duplicates Z: 27 24.236 2.029 0.842 0.540 0.923 0.692 CB 1.324 27 residues pruned to eliminate duplicates Z: 26 24.879 2.038 0.922 0.564 0.920 0.680 CB 1.298 26 residues pruned to eliminate duplicates Z: 24 22.422 2.004 0.894 0.590 0.913 0.696 CB 1.237 25 residues pruned to eliminate duplicates Z: 24 29.132 2.078 0.893 0.600 1.000 0.739 CB 1.404 24 residues pruned to eliminate duplicates Z: 25 26.929 2.085 0.918 0.577 0.917 0.708 CB 1.392 25 residues pruned to eliminate duplicates Z: 25 27.557 2.082 1.030 0.573 0.917 0.708 CB 1.353 25 residues pruned to eliminate duplicates Z: 25 27.386 2.090 0.927 0.555 0.917 0.708 CB 1.436 25 residues pruned to eliminate duplicates Z: 25 24.840 2.041 0.956 0.572 0.875 0.750 CB 1.354 25 residues pruned to eliminate duplicates Z: 25 26.654 2.082 0.957 0.551 0.917 0.667 CB 1.387 25 residues pruned to eliminate duplicates Z: 26 22.172 2.036 0.838 0.503 0.920 0.520 CB 1.285 26 residues pruned to eliminate duplicates Z: 25 25.086 2.012 0.952 0.523 0.875 0.667 CB 1.457 25 residues pruned to eliminate duplicates Z: 27 26.048 2.055 0.936 0.524 0.962 0.615 CB 1.304 27 residues pruned to eliminate duplicates Z: 24 28.899 2.082 0.956 0.585 0.957 0.696 CB 1.426 24 residues pruned to eliminate duplicates Z: 25 26.312 2.082 0.955 0.570 0.875 0.750 CB 1.409 25 residues pruned to eliminate duplicates Z: 10 23.220 2.167 1.434 0.640 0.778 0.778 CB 1.655 10 residues pruned to eliminate duplicates Z: 25 28.421 2.078 1.086 0.560 0.917 0.750 CB 1.377 25 residues pruned to eliminate duplicates Z: 27 23.717 2.007 0.816 0.528 0.923 0.692 CB 1.345 27 residues pruned to eliminate duplicates Z: 27 22.258 2.001 0.776 0.489 0.885 0.577 CB 1.404 27 residues pruned to eliminate duplicates Z: 35 26.891 1.950 0.973 0.531 0.941 0.500 CB 1.236 21 residues pruned to eliminate duplicates Z: 6 4.727 2.149 0.075 0.366 0.800 0.600 CA 1.321 6 residues pruned to eliminate duplicates Z: 20 19.081 2.195 0.578 0.462 0.947 0.526 CB 1.387 18 residues pruned to eliminate duplicates Z: 6 5.975 1.997 0.366 0.268 0.800 0.800 CA 1.594 9 residues pruned to eliminate duplicates Z: 6 5.063 1.708 0.945 0.459 1.000 0.800 CA 0.711 6 residues pruned to eliminate duplicates Z: 18 20.723 2.146 0.731 0.529 0.941 0.588 CB 1.398 20 residues pruned to eliminate duplicates Z: 6 6.105 1.895 1.152 0.288 0.800 0.400 CA 1.062 6 residues pruned to eliminate duplicates Z: 19 19.812 2.197 0.617 0.508 0.889 0.611 CA 1.467 19 residues pruned to eliminate duplicates Z: 20 21.912 2.148 0.637 0.534 0.947 0.632 CB 1.459 20 residues pruned to eliminate duplicates Z: 20 19.837 2.164 0.725 0.485 0.895 0.579 CB 1.383 20 residues pruned to eliminate duplicates Z: 17 23.581 2.327 0.857 0.479 0.875 0.625 CB 1.593 15 residues pruned to eliminate duplicates Z: 7 4.554 1.627 0.095 0.449 1.000 0.500 CA 1.100 7 residues pruned to eliminate duplicates Z: 33 39.051 2.163 0.706 0.710 0.969 0.844 CB 1.595 50 residues pruned to eliminate duplicates Z: 17 14.455 1.838 0.764 0.477 0.875 0.562 CA 1.304 Z: 6 4.341 1.602 0.177 0.383 1.000 0.600 CA 1.166 6 residues pruned to eliminate duplicates Z: 37 34.697 2.082 0.755 0.655 0.944 0.722 CB 1.451 54 residues pruned to eliminate duplicates Z: 23 15.440 1.869 0.640 0.397 0.864 0.455 CA 1.386 23 residues pruned to eliminate duplicates Z: 17 16.965 1.951 0.715 0.478 0.938 0.625 CB 1.383 Z: 8 12.661 1.817 0.672 0.879 1.000 0.714 CA 1.142 8 residues pruned to eliminate duplicates Z: 19 20.576 1.966 0.821 0.505 0.944 0.611 CB 1.426 19 residues pruned to eliminate duplicates Z: 20 19.091 1.853 0.808 0.543 1.000 0.737 CB 1.253 20 residues pruned to eliminate duplicates Z: 19 22.530 1.939 0.888 0.548 1.000 0.778 CB 1.385 19 residues pruned to eliminate duplicates Z: 8 13.420 1.809 0.670 0.883 1.000 0.857 CB 1.214 8 residues pruned to eliminate duplicates Z: 19 20.369 1.943 0.838 0.518 0.944 0.722 CB 1.399 19 residues pruned to eliminate duplicates Z: 20 19.474 1.875 0.834 0.533 0.947 0.579 CB 1.328 20 residues pruned to eliminate duplicates Z: 15 19.593 2.033 0.890 0.472 1.000 0.714 CB 1.403 15 residues pruned to eliminate duplicates Z: 19 20.075 1.908 0.934 0.563 0.944 0.556 CB 1.277 19 residues pruned to eliminate duplicates Z: 15 17.521 2.008 1.050 0.451 0.929 0.714 CB 1.288 15 residues pruned to eliminate duplicates Z: 19 22.778 1.960 1.058 0.534 0.944 0.611 CB 1.362 19 residues pruned to eliminate duplicates Z: 20 20.820 1.900 0.907 0.512 0.947 0.474 CB 1.376 20 residues pruned to eliminate duplicates Z: 20 19.806 1.858 0.840 0.521 0.947 0.579 CB 1.373 20 residues pruned to eliminate duplicates Z: 21 18.425 1.823 0.799 0.525 1.000 0.600 CB 1.226 21 residues pruned to eliminate duplicates Z: 21 24.001 2.058 0.642 0.492 1.000 0.750 CB 1.601 21 residues pruned to eliminate duplicates Z: 22 27.447 2.040 0.724 0.577 1.000 0.762 CB 1.581 21 residues pruned to eliminate duplicates Z: 9 17.059 2.146 0.437 0.768 1.000 0.750 CB 1.542 9 residues pruned to eliminate duplicates Z: 20 27.083 2.104 0.712 0.548 1.000 0.842 CB 1.647 20 residues pruned to eliminate duplicates Z: 21 25.086 2.067 0.744 0.493 1.000 0.850 CB 1.567 21 residues pruned to eliminate duplicates Z: 18 23.489 2.183 0.713 0.458 1.000 0.647 CB 1.590 18 residues pruned to eliminate duplicates Z: 20 29.028 2.121 0.765 0.556 1.000 0.842 CB 1.684 21 residues pruned to eliminate duplicates Z: 12 18.984 2.165 0.553 0.649 1.000 0.727 CA 1.482 12 residues pruned to eliminate duplicates Z: 12 16.122 2.059 0.577 0.580 1.000 0.636 CB 1.386 12 residues pruned to eliminate duplicates Z: 22 24.504 2.053 0.741 0.495 0.952 0.619 CB 1.578 22 residues pruned to eliminate duplicates Z: 19 28.013 2.183 0.779 0.524 1.000 0.833 CB 1.662 19 residues pruned to eliminate duplicates Z: 19 28.982 2.183 0.850 0.507 1.000 0.722 CB 1.679 20 residues pruned to eliminate duplicates 6 1.706 1.243 0.537 0.464 0.800 0.400 CA 0.518 ? Z: 7 7.155 1.717 0.061 0.911 1.000 0.833 CB 1.136 7 residues pruned to eliminate duplicates Z: 15 8.465 1.806 -0.184 0.928 1.000 0.929 CB 1.075 15 residues pruned to eliminate duplicates Z: 18 12.245 1.690 0.218 0.822 1.000 0.824 CB 1.092 18 residues pruned to eliminate duplicates Z: 17 15.397 1.762 0.473 0.874 0.938 0.938 CB 1.151 17 residues pruned to eliminate duplicates Z: 16 18.131 1.806 0.610 0.932 1.000 0.800 CB 1.124 16 residues pruned to eliminate duplicates Z: 15 14.735 1.818 0.416 0.937 1.000 0.714 CB 1.065 15 residues pruned to eliminate duplicates Z: 16 16.765 1.821 0.544 0.936 1.000 0.600 CB 1.072 16 residues pruned to eliminate duplicates Z: 15 20.341 1.849 0.811 0.941 1.000 0.643 CB 1.127 15 residues pruned to eliminate duplicates Z: 15 19.298 1.824 0.808 0.944 1.000 0.429 CB 1.084 15 residues pruned to eliminate duplicates Z: 17 16.652 1.739 0.678 0.869 1.000 0.500 CB 1.042 17 residues pruned to eliminate duplicates Z: 17 18.217 1.735 0.761 0.884 1.000 0.750 CB 1.077 17 residues pruned to eliminate duplicates Z: 16 19.868 1.813 0.775 0.938 1.000 0.667 CB 1.108 16 residues pruned to eliminate duplicates Z: 15 17.454 1.822 0.653 0.923 1.000 0.643 CB 1.088 15 residues pruned to eliminate duplicates Z: 16 16.539 1.815 0.502 0.919 1.000 0.667 CB 1.103 16 residues pruned to eliminate duplicates Z: 14 20.959 2.136 0.684 0.495 1.000 0.769 CB 1.624 14 residues pruned to eliminate duplicates Z: 14 18.657 2.099 0.538 0.491 1.000 0.923 CB 1.617 14 residues pruned to eliminate duplicates Z: 14 17.915 2.199 0.681 0.369 1.000 0.692 CB 1.546 14 residues pruned to eliminate duplicates Z: 15 17.272 2.130 0.638 0.359 1.000 0.714 CB 1.540 15 residues pruned to eliminate duplicates Z: 16 18.995 2.061 0.789 0.400 1.000 0.667 CA 1.478 16 residues pruned to eliminate duplicates Z: 29 18.450 2.164 0.596 0.372 0.821 0.464 CB 1.409 29 residues pruned to eliminate duplicates Z: 16 16.831 2.064 0.601 0.396 1.000 0.733 CB 1.468 16 residues pruned to eliminate duplicates Z: 14 20.490 2.185 0.735 0.474 1.000 0.538 CB 1.539 14 residues pruned to eliminate duplicates Z: 15 16.907 2.088 0.611 0.410 1.000 0.571 CB 1.476 15 residues pruned to eliminate duplicates Z: 14 12.601 1.959 0.826 0.374 0.846 0.692 CB 1.321 14 residues pruned to eliminate duplicates Z: 12 18.452 2.155 0.982 0.468 0.909 0.727 CB 1.480 12 residues pruned to eliminate duplicates Z: 14 14.924 2.016 0.817 0.379 0.923 0.538 CB 1.393 14 residues pruned to eliminate duplicates Z: 32 29.691 2.322 0.749 0.410 0.871 0.387 CB 1.657 32 residues pruned to eliminate duplicates Z: 26 28.311 2.413 0.674 0.438 0.840 0.400 CB 1.778 26 residues pruned to eliminate duplicates Z: 24 34.858 2.499 0.746 0.444 0.913 0.391 CA 1.933 24 residues pruned to eliminate duplicates Z: 20 32.571 2.494 0.878 0.484 0.842 0.421 CB 1.925 20 residues pruned to eliminate duplicates Z: 26 33.080 2.359 0.733 0.452 0.960 0.400 CB 1.770 26 residues pruned to eliminate duplicates Z: 8 20.861 2.285 1.369 0.633 0.857 0.571 CA 1.499 8 residues pruned to eliminate duplicates Z: 30 33.627 2.401 0.727 0.430 0.931 0.414 CB 1.739 30 residues pruned to eliminate duplicates Z: 38 44.014 2.360 0.979 0.504 0.919 0.595 CB 1.680 38 residues pruned to eliminate duplicates Z: 29 25.900 2.314 0.837 0.297 0.857 0.464 CB 1.685 29 residues pruned to eliminate duplicates Z: 19 24.267 2.361 0.701 0.415 0.889 0.389 CA 1.751 19 residues pruned to eliminate duplicates Z: 19 36.660 2.509 0.950 0.544 0.889 0.556 CB 1.903 19 residues pruned to eliminate duplicates Z: 20 25.226 2.386 0.550 0.344 0.947 0.316 CB 1.956 20 residues pruned to eliminate duplicates Z: 20 33.941 2.538 0.622 0.454 1.000 0.474 CB 1.982 20 residues pruned to eliminate duplicates Z: 21 34.745 2.387 0.950 0.496 0.950 0.650 CA 1.764 21 residues pruned to eliminate duplicates Z: 29 28.873 2.332 0.943 0.363 0.786 0.464 CB 1.776 29 residues pruned to eliminate duplicates Z: 20 37.317 2.455 1.034 0.520 0.895 0.684 CB 1.878 20 residues pruned to eliminate duplicates Z: 21 32.640 2.494 1.004 0.414 0.850 0.450 CB 1.879 21 residues pruned to eliminate duplicates Z: 24 39.959 2.522 0.938 0.504 0.870 0.478 CB 1.953 24 residues pruned to eliminate duplicates Z: 26 24.299 2.407 0.624 0.368 0.880 0.360 CB 1.628 26 residues pruned to eliminate duplicates Z: 25 15.502 2.256 0.705 0.218 0.708 0.250 CB 1.619 25 residues pruned to eliminate duplicates Z: 26 35.069 2.440 0.849 0.482 0.880 0.440 CB 1.799 26 residues pruned to eliminate duplicates Z: 15 11.619 2.170 0.694 0.306 0.786 0.286 CB 1.335 15 residues pruned to eliminate duplicates Z: 6 6.593 2.014 0.240 0.553 0.800 0.800 CA 1.402 6 residues pruned to eliminate duplicates Z: 110 52.035 2.153 0.777 0.536 0.881 0.523 CB 1.428 187 residues pruned to eliminate duplicates Z: 81 54.863 2.225 0.806 0.579 0.938 0.538 CB 1.510 81 residues pruned to eliminate duplicates Z: 74 52.426 2.268 0.823 0.571 0.918 0.534 CB 1.510 74 residues pruned to eliminate duplicates Z: 105 48.356 2.168 0.667 0.528 0.875 0.644 CB 1.458 105 residues pruned to eliminate duplicates Z: 89 51.524 2.176 0.771 0.569 0.920 0.580 CB 1.448 89 residues pruned to eliminate duplicates Z: 37 31.705 2.248 0.614 0.525 0.889 0.556 CB 1.599 37 residues pruned to eliminate duplicates Z: 78 50.354 2.199 0.895 0.561 0.870 0.610 CB 1.492 78 residues pruned to eliminate duplicates Z: 99 51.820 2.158 0.752 0.542 0.908 0.684 CB 1.463 99 residues pruned to eliminate duplicates Z: 99 49.427 2.163 0.745 0.544 0.867 0.582 CB 1.462 99 residues pruned to eliminate duplicates Z: 67 51.047 2.283 0.796 0.614 0.894 0.545 CB 1.539 Z: 15 33.343 2.360 0.849 0.848 1.000 0.643 CB 1.514 19 residues pruned to eliminate duplicates Z: 18 27.342 2.032 0.969 0.827 0.882 0.588 CA 1.415 17 residues pruned to eliminate duplicates Z: 14 33.277 2.345 0.900 0.846 0.923 0.615 CB 1.668 14 residues pruned to eliminate duplicates Z: 71 51.426 2.270 0.794 0.576 0.929 0.586 CB 1.510 135 residues pruned to eliminate duplicates Z: 117 60.168 2.247 0.806 0.516 0.888 0.552 CB 1.527 117 residues pruned to eliminate duplicates Z: 80 48.446 2.172 0.785 0.537 0.911 0.506 CB 1.487 80 residues pruned to eliminate duplicates Z: 84 46.475 2.187 0.775 0.569 0.855 0.627 CB 1.437 84 residues pruned to eliminate duplicates Z: 70 47.996 2.255 0.769 0.584 0.899 0.522 CB 1.486 Z: 16 31.675 2.282 0.797 0.742 1.000 0.600 CA 1.606 16 residues pruned to eliminate duplicates Z: 80 55.352 2.240 0.839 0.559 0.924 0.519 CB 1.544 150 residues pruned to eliminate duplicates Z: 116 62.602 2.248 0.798 0.524 0.904 0.565 CB 1.559 116 residues pruned to eliminate duplicates Z: 100 54.072 2.146 0.788 0.558 0.919 0.586 CB 1.456 100 residues pruned to eliminate duplicates Z: 75 46.577 2.215 0.774 0.554 0.892 0.608 CB 1.466 75 residues pruned to eliminate duplicates Z: 72 50.015 2.238 0.745 0.571 0.944 0.549 CB 1.505 72 residues pruned to eliminate duplicates Z: 46 38.376 2.262 0.742 0.520 0.933 0.556 CB 1.525 46 residues pruned to eliminate duplicates Z: 95 50.845 2.154 0.696 0.564 0.926 0.606 CB 1.458 Z: 7 6.421 1.700 0.422 0.379 1.000 0.833 CB 1.234 7 residues pruned to eliminate duplicates Z: 72 51.345 2.240 0.805 0.565 0.944 0.549 CB 1.500 72 residues pruned to eliminate duplicates Z: 7 8.041 1.835 0.445 0.534 0.833 0.500 CA 1.437 7 residues pruned to eliminate duplicates Z: 80 52.797 2.246 0.851 0.560 0.899 0.582 CB 1.500 175 residues pruned to eliminate duplicates Z: 64 47.913 2.290 0.734 0.556 0.921 0.492 CB 1.563 64 residues pruned to eliminate duplicates Z: 114 53.783 2.132 0.750 0.545 0.903 0.540 CB 1.437 114 residues pruned to eliminate duplicates Z: 84 50.614 2.225 0.817 0.551 0.880 0.554 CB 1.487 84 residues pruned to eliminate duplicates Z: 99 52.219 2.153 0.711 0.563 0.939 0.622 CB 1.434 99 residues pruned to eliminate duplicates Z: 70 54.109 2.254 0.879 0.568 0.957 0.580 CB 1.506 Z: 15 30.514 2.243 1.007 0.775 0.929 0.643 CB 1.530 15 residues pruned to eliminate duplicates Z: 76 51.327 2.223 0.754 0.572 0.947 0.600 CB 1.497 76 residues pruned to eliminate duplicates Z: 14 33.102 2.335 0.918 0.765 1.000 0.462 CB 1.621 14 residues pruned to eliminate duplicates Z: 86 51.932 2.168 0.814 0.564 0.929 0.576 CB 1.448 73 residues pruned to eliminate duplicates Z: 17 30.602 2.225 0.986 0.799 0.812 0.625 CB 1.640 17 residues pruned to eliminate duplicates Z: 80 49.279 2.194 0.883 0.547 0.886 0.595 CB 1.447 80 residues pruned to eliminate duplicates Z: 101 49.216 2.109 0.724 0.549 0.920 0.580 CB 1.402 90 residues pruned to eliminate duplicates Z: 14 28.474 2.109 1.077 0.791 0.923 0.538 CB 1.514 14 residues pruned to eliminate duplicates Z: 69 52.271 2.276 0.857 0.574 0.926 0.618 CB 1.507 69 residues pruned to eliminate duplicates Z: 68 53.534 2.290 0.867 0.600 0.940 0.597 CB 1.479 68 residues pruned to eliminate duplicates Z: 104 54.402 2.165 0.781 0.561 0.903 0.631 CB 1.451 198 residues pruned to eliminate duplicates Z: 93 52.166 2.167 0.817 0.554 0.913 0.630 CB 1.436 Z: 13 16.467 2.015 0.789 0.669 0.917 0.500 CB 1.230 13 residues pruned to eliminate duplicates Z: 77 51.487 2.220 0.825 0.569 0.934 0.605 CB 1.459 77 residues pruned to eliminate duplicates Z: 88 49.755 2.206 0.815 0.539 0.874 0.552 CB 1.468 181 residues pruned to eliminate duplicates Z: 83 53.084 2.191 0.839 0.575 0.915 0.585 CB 1.479 83 residues pruned to eliminate duplicates Z: 71 52.753 2.255 0.867 0.576 0.943 0.586 CB 1.476 71 residues pruned to eliminate duplicates Z: 40 24.827 1.987 0.793 0.550 0.872 0.590 CB 1.219 Z: 11 15.908 2.137 0.777 0.856 0.900 0.600 CB 1.085 11 residues pruned to eliminate duplicates Z: 100 50.454 2.130 0.791 0.547 0.889 0.556 CB 1.428 140 residues pruned to eliminate duplicates Z: 76 55.210 2.249 0.898 0.583 0.920 0.600 CB 1.499 76 residues pruned to eliminate duplicates Z: 82 53.821 2.224 0.933 0.553 0.889 0.580 CB 1.486 82 residues pruned to eliminate duplicates Z: 71 52.525 2.246 0.893 0.574 0.929 0.457 CB 1.481 Z: 12 20.188 2.132 0.960 0.843 0.909 0.636 CB 1.193 12 residues pruned to eliminate duplicates Z: 107 56.960 2.157 0.837 0.557 0.925 0.566 CB 1.428 178 residues pruned to eliminate duplicates Z: 78 54.834 2.206 0.873 0.581 0.948 0.571 CB 1.475 Z: 6 5.468 1.565 0.946 0.347 0.800 0.600 CA 1.185 Z: 6 6.830 1.776 0.788 0.394 1.000 0.800 CA 1.076 6 residues pruned to eliminate duplicates Z: 95 52.658 2.158 0.814 0.569 0.915 0.585 CB 1.419 84 residues pruned to eliminate duplicates Z: 7 4.549 1.610 0.521 0.468 1.000 0.500 CA 0.784 7 residues pruned to eliminate duplicates Z: 32 35.409 2.212 0.718 0.607 0.935 0.516 CB 1.615 32 residues pruned to eliminate duplicates Z: 42 35.788 2.177 0.558 0.662 0.951 0.659 CB 1.490 42 residues pruned to eliminate duplicates Z: 92 42.878 2.160 0.509 0.599 0.890 0.626 CB 1.410 92 residues pruned to eliminate duplicates Z: 88 44.238 2.157 0.577 0.595 0.920 0.598 CB 1.384 88 residues pruned to eliminate duplicates Z: 123 56.633 2.176 0.656 0.617 0.918 0.680 CB 1.387 123 residues pruned to eliminate duplicates Z: 41 39.519 2.200 0.719 0.644 0.925 0.700 CB 1.561 41 residues pruned to eliminate duplicates Z: 30 37.338 2.236 0.677 0.650 0.966 0.655 CB 1.666 30 residues pruned to eliminate duplicates Z: 91 45.671 2.159 0.552 0.607 0.922 0.678 CB 1.408 91 residues pruned to eliminate duplicates Z: 30 38.771 2.273 0.647 0.645 0.966 0.690 CB 1.740 30 residues pruned to eliminate duplicates Z: 106 53.042 2.170 0.629 0.640 0.924 0.676 CB 1.390 106 residues pruned to eliminate duplicates Z: 71 42.415 2.183 0.525 0.678 0.929 0.643 CB 1.393 71 residues pruned to eliminate duplicates Z: 38 40.961 2.238 0.859 0.575 0.919 0.595 CB 1.639 38 residues pruned to eliminate duplicates Z: 42 33.288 2.174 0.574 0.606 0.902 0.659 CB 1.522 42 residues pruned to eliminate duplicates Z: 70 47.929 2.193 0.639 0.680 0.957 0.739 CB 1.422 70 residues pruned to eliminate duplicates Z: 32 31.922 2.223 0.617 0.566 0.903 0.645 CB 1.657 32 residues pruned to eliminate duplicates Z: 41 36.972 2.191 0.702 0.628 0.925 0.800 CB 1.502 41 residues pruned to eliminate duplicates Z: 21 41.039 2.287 0.843 0.839 1.000 0.850 CB 1.626 21 residues pruned to eliminate duplicates Z: 69 46.016 2.186 0.672 0.600 0.882 0.574 CB 1.573 69 residues pruned to eliminate duplicates Z: 32 35.717 2.234 0.662 0.572 0.968 0.710 CB 1.666 32 residues pruned to eliminate duplicates Z: 21 39.973 2.292 0.788 0.837 1.000 0.850 CB 1.631 21 residues pruned to eliminate duplicates Z: 22 37.193 2.254 0.840 0.851 0.952 0.762 CB 1.521 22 residues pruned to eliminate duplicates Z: 70 43.053 2.171 0.605 0.677 0.913 0.696 CB 1.384 70 residues pruned to eliminate duplicates Z: 34 39.506 2.234 0.685 0.825 0.939 0.758 CB 1.468 34 residues pruned to eliminate duplicates Z: 39 35.810 2.153 0.565 0.798 0.921 0.763 CB 1.442 39 residues pruned to eliminate duplicates Z: 83 45.266 2.164 0.575 0.622 0.927 0.634 CB 1.411 83 residues pruned to eliminate duplicates Z: 23 29.013 2.265 0.520 0.799 0.909 0.682 CB 1.522 23 residues pruned to eliminate duplicates Z: 48 38.968 2.204 0.581 0.668 0.957 0.660 CB 1.458 48 residues pruned to eliminate duplicates Z: 31 21.069 2.088 0.496 0.510 0.900 0.533 CB 1.354 31 residues pruned to eliminate duplicates Z: 33 32.989 2.180 0.561 0.760 0.906 0.625 CB 1.501 33 residues pruned to eliminate duplicates Z: 18 25.043 2.188 0.481 0.757 1.000 0.647 CB 1.491 18 residues pruned to eliminate duplicates Z: 37 42.945 2.203 0.665 0.783 1.000 0.694 CB 1.521 37 residues pruned to eliminate duplicates Z: 79 49.287 2.176 0.675 0.635 0.910 0.641 CB 1.482 79 residues pruned to eliminate duplicates Z: 28 19.238 2.097 0.331 0.554 0.963 0.556 CB 1.308 28 residues pruned to eliminate duplicates Z: 47 36.461 2.200 0.538 0.683 0.935 0.630 CB 1.437 47 residues pruned to eliminate duplicates Z: 28 20.477 2.087 0.426 0.563 0.926 0.630 CB 1.345 28 residues pruned to eliminate duplicates Z: 103 54.308 2.183 0.592 0.659 0.951 0.657 CB 1.404 103 residues pruned to eliminate duplicates Z: 123 57.682 2.162 0.600 0.622 0.943 0.672 CB 1.428 123 residues pruned to eliminate duplicates Z: 103 57.991 2.194 0.694 0.668 0.931 0.686 CB 1.420 103 residues pruned to eliminate duplicates Z: 87 45.485 2.166 0.615 0.621 0.907 0.651 CB 1.379 87 residues pruned to eliminate duplicates Z: 71 42.147 2.162 0.552 0.669 0.943 0.671 CB 1.362 71 residues pruned to eliminate duplicates Z: 104 56.198 2.171 0.700 0.631 0.913 0.689 CB 1.453 104 residues pruned to eliminate duplicates Z: 93 46.986 2.154 0.581 0.600 0.913 0.630 CB 1.432 93 residues pruned to eliminate duplicates Z: 104 57.705 2.248 0.703 0.566 0.903 0.641 CB 1.543 104 residues pruned to eliminate duplicates Z: 103 48.816 2.130 0.663 0.637 0.892 0.618 CB 1.346 103 residues pruned to eliminate duplicates Z: 107 52.656 2.160 0.590 0.615 0.934 0.745 CB 1.429 107 residues pruned to eliminate duplicates Z: 55 42.957 2.200 0.611 0.626 0.963 0.667 CB 1.521 55 residues pruned to eliminate duplicates Z: 49 38.451 2.188 0.524 0.680 0.958 0.708 CB 1.472 49 residues pruned to eliminate duplicates Z: 53 29.911 2.141 0.440 0.584 0.923 0.615 CB 1.345 53 residues pruned to eliminate duplicates Z: 72 46.240 2.167 0.591 0.675 0.930 0.662 CB 1.457 72 residues pruned to eliminate duplicates Z: 122 58.682 2.177 0.640 0.625 0.942 0.678 CB 1.410 122 residues pruned to eliminate duplicates Z: 55 33.735 2.120 0.589 0.580 0.907 0.481 CB 1.391 55 residues pruned to eliminate duplicates Z: 88 50.081 2.197 0.650 0.612 0.920 0.598 CB 1.448 88 residues pruned to eliminate duplicates Z: 112 55.588 2.175 0.624 0.620 0.928 0.685 CB 1.437 112 residues pruned to eliminate duplicates Z: 24 26.776 2.146 0.749 0.659 0.957 0.739 CB 1.342 24 residues pruned to eliminate duplicates Z: 24 26.675 2.229 0.674 0.658 0.913 0.565 CB 1.409 24 residues pruned to eliminate duplicates Z: 39 32.782 2.143 0.829 0.580 0.921 0.632 CB 1.364 39 residues pruned to eliminate duplicates Z: 36 23.723 2.069 0.475 0.540 0.914 0.600 CB 1.382 36 residues pruned to eliminate duplicates Z: 24 26.841 2.141 0.600 0.667 0.957 0.696 CB 1.464 24 residues pruned to eliminate duplicates Z: 105 52.466 2.199 0.620 0.609 0.894 0.625 CB 1.457 105 residues pruned to eliminate duplicates Z: 23 28.587 2.225 0.625 0.689 0.955 0.773 CB 1.485 23 residues pruned to eliminate duplicates Z: 71 43.118 2.188 0.566 0.669 0.914 0.671 CB 1.407 71 residues pruned to eliminate duplicates Z: 58 38.887 2.125 0.648 0.653 0.912 0.719 CB 1.398 58 residues pruned to eliminate duplicates Z: 77 49.333 2.221 0.609 0.642 0.934 0.776 CB 1.485 77 residues pruned to eliminate duplicates Z: 90 46.693 2.142 0.628 0.608 0.921 0.685 CB 1.390 90 residues pruned to eliminate duplicates Z: 59 34.427 2.179 0.546 0.615 0.845 0.655 CB 1.424 59 residues pruned to eliminate duplicates Z: 28 23.511 2.195 0.588 0.582 0.852 0.593 CB 1.408 28 residues pruned to eliminate duplicates Z: 77 40.592 2.096 0.768 0.567 0.855 0.566 CB 1.377 77 residues pruned to eliminate duplicates Z: 28 21.648 2.087 0.645 0.599 0.815 0.593 CB 1.354 28 residues pruned to eliminate duplicates Z: 33 20.012 2.095 0.591 0.509 0.812 0.531 CB 1.295 33 residues pruned to eliminate duplicates Z: 24 29.196 2.215 0.752 0.658 0.957 0.652 CB 1.416 24 residues pruned to eliminate duplicates Z: 69 46.525 2.195 0.644 0.686 0.926 0.618 CB 1.423 69 residues pruned to eliminate duplicates Z: 26 22.049 2.096 0.629 0.609 0.880 0.600 CB 1.323 26 residues pruned to eliminate duplicates Z: 71 46.132 2.184 0.624 0.663 0.943 0.657 CB 1.417 71 residues pruned to eliminate duplicates Z: 57 42.652 2.157 0.779 0.666 0.929 0.696 CB 1.371 57 residues pruned to eliminate duplicates Z: 71 46.335 2.182 0.614 0.672 0.943 0.600 CB 1.424 71 residues pruned to eliminate duplicates Z: 52 35.281 2.138 0.591 0.622 0.902 0.627 CB 1.436 52 residues pruned to eliminate duplicates Z: 43 30.947 2.158 0.608 0.589 0.905 0.667 CB 1.396 43 residues pruned to eliminate duplicates Z: 43 31.496 2.132 0.700 0.561 0.881 0.643 CB 1.435 43 residues pruned to eliminate duplicates Z: 34 28.758 2.139 0.612 0.597 0.909 0.697 CB 1.456 34 residues pruned to eliminate duplicates Z: 24 17.946 2.043 0.572 0.471 0.826 0.609 CB 1.453 24 residues pruned to eliminate duplicates Z: 18 19.257 2.152 0.836 0.491 0.824 0.529 CB 1.450 18 residues pruned to eliminate duplicates Z: 36 28.559 2.112 0.670 0.639 0.857 0.686 CB 1.401 36 residues pruned to eliminate duplicates Z: 38 33.078 2.160 0.785 0.643 0.865 0.757 CB 1.427 38 residues pruned to eliminate duplicates Z: 23 24.915 2.137 0.824 0.570 0.864 0.682 CB 1.474 23 residues pruned to eliminate duplicates Z: 41 30.766 2.109 0.565 0.627 0.925 0.650 CB 1.413 41 residues pruned to eliminate duplicates Z: 36 34.223 2.240 0.847 0.486 0.886 0.600 CB 1.601 36 residues pruned to eliminate duplicates Z: 40 32.442 2.142 0.745 0.613 0.897 0.667 CB 1.393 40 residues pruned to eliminate duplicates Z: 91 41.463 2.118 0.634 0.594 0.867 0.644 CB 1.332 91 residues pruned to eliminate duplicates Z: 31 21.246 2.034 0.490 0.598 0.900 0.700 CB 1.295 31 residues pruned to eliminate duplicates Z: 40 29.941 2.147 0.663 0.596 0.872 0.718 CB 1.406 40 residues pruned to eliminate duplicates Z: 22 22.517 2.081 0.878 0.584 0.857 0.667 CB 1.354 22 residues pruned to eliminate duplicates Z: 100 56.311 2.167 0.671 0.677 0.939 0.677 CB 1.413 100 residues pruned to eliminate duplicates Z: 34 23.180 1.993 0.610 0.572 0.879 0.667 CB 1.334 34 residues pruned to eliminate duplicates Z: 26 23.762 2.083 0.536 0.651 0.920 0.760 CB 1.402 26 residues pruned to eliminate duplicates Z: 32 22.269 2.039 0.580 0.596 0.871 0.645 CB 1.300 32 residues pruned to eliminate duplicates Z: 39 32.869 2.109 0.875 0.628 0.895 0.684 CB 1.336 39 residues pruned to eliminate duplicates Z: 40 29.887 2.110 0.806 0.583 0.897 0.667 CB 1.292 40 residues pruned to eliminate duplicates Z: 23 26.557 2.058 0.803 0.733 0.909 0.818 CB 1.362 23 residues pruned to eliminate duplicates Z: 40 32.119 2.150 0.779 0.618 0.923 0.641 CB 1.302 40 residues pruned to eliminate duplicates Z: 44 33.370 2.209 0.625 0.599 0.837 0.605 CB 1.541 44 residues pruned to eliminate duplicates Z: 23 29.865 2.120 1.111 0.693 0.909 0.545 CB 1.313 23 residues pruned to eliminate duplicates Z: 39 33.262 2.148 0.872 0.610 0.895 0.632 CB 1.351 39 residues pruned to eliminate duplicates Z: 22 27.551 2.113 0.990 0.733 0.905 0.524 CB 1.282 22 residues pruned to eliminate duplicates Z: 23 28.194 2.087 0.979 0.697 0.909 0.364 CB 1.337 23 residues pruned to eliminate duplicates Z: 21 29.833 2.154 0.998 0.770 0.950 0.600 CB 1.284 21 residues pruned to eliminate duplicates Z: 25 25.045 2.108 0.932 0.659 0.917 0.500 CB 1.181 25 residues pruned to eliminate duplicates Z: 29 29.467 2.084 0.846 0.663 0.893 0.714 CB 1.393 29 residues pruned to eliminate duplicates Z: 35 27.450 2.341 0.548 0.411 0.882 0.529 CB 1.615 35 residues pruned to eliminate duplicates Z: 66 50.582 2.285 0.840 0.606 0.923 0.600 CB 1.461 66 residues pruned to eliminate duplicates Z: 53 48.091 2.251 0.869 0.591 0.904 0.538 CB 1.608 53 residues pruned to eliminate duplicates Z: 71 50.111 2.220 0.928 0.549 0.886 0.529 CB 1.506 71 residues pruned to eliminate duplicates Z: 71 44.610 2.191 0.856 0.534 0.857 0.557 CB 1.479 71 residues pruned to eliminate duplicates Z: 141 62.968 2.191 0.754 0.591 0.893 0.614 CB 1.422 141 residues pruned to eliminate duplicates Z: 27 32.906 2.447 0.675 0.476 0.885 0.462 CA 1.823 27 residues pruned to eliminate duplicates Z: 20 27.741 2.388 0.758 0.474 0.895 0.579 CB 1.740 20 residues pruned to eliminate duplicates Z: 18 34.342 2.457 0.824 0.560 0.941 0.529 CB 1.863 18 residues pruned to eliminate duplicates Z: 37 34.110 2.354 0.777 0.416 0.833 0.528 CB 1.780 37 residues pruned to eliminate duplicates Z: 20 30.876 2.359 0.729 0.485 0.947 0.474 CA 1.861 20 residues pruned to eliminate duplicates Z: 68 49.329 2.249 0.923 0.560 0.866 0.552 CB 1.519 68 residues pruned to eliminate duplicates Z: 33 34.721 2.315 0.814 0.420 0.875 0.562 CB 1.815 33 residues pruned to eliminate duplicates Z: 48 41.500 2.239 0.852 0.555 0.851 0.617 CB 1.626 48 residues pruned to eliminate duplicates Z: 68 41.004 2.194 0.879 0.512 0.836 0.463 CB 1.436 68 residues pruned to eliminate duplicates Z: 28 36.320 2.454 0.821 0.433 0.926 0.481 CB 1.811 28 residues pruned to eliminate duplicates Z: 30 31.646 2.392 0.609 0.503 0.862 0.517 CB 1.765 30 residues pruned to eliminate duplicates Z: 51 50.542 2.300 0.926 0.583 0.920 0.620 CB 1.619 51 residues pruned to eliminate duplicates Z: 22 30.226 2.255 0.728 0.567 0.952 0.619 CA 1.666 22 residues pruned to eliminate duplicates Z: 29 35.718 2.428 0.789 0.458 0.893 0.571 CB 1.816 29 residues pruned to eliminate duplicates Z: 28 39.008 2.452 0.747 0.485 0.963 0.556 CB 1.848 28 residues pruned to eliminate duplicates Z: 69 51.271 2.269 0.936 0.557 0.882 0.588 CB 1.518 69 residues pruned to eliminate duplicates Z: 30 36.077 2.404 0.719 0.492 0.931 0.690 CB 1.755 30 residues pruned to eliminate duplicates Z: 29 36.662 2.436 0.755 0.465 0.929 0.536 CB 1.808 29 residues pruned to eliminate duplicates Z: 30 36.798 2.348 0.890 0.480 0.862 0.586 CB 1.823 30 residues pruned to eliminate duplicates Z: 94 57.376 2.178 0.918 0.591 0.892 0.570 CB 1.462 94 residues pruned to eliminate duplicates Z: 29 34.704 2.355 0.659 0.543 0.929 0.643 CA 1.733 29 residues pruned to eliminate duplicates Z: 62 51.396 2.378 0.603 0.590 0.918 0.705 CB 1.726 62 residues pruned to eliminate duplicates Z: 11 18.184 2.383 0.637 0.414 0.900 0.600 CA 1.792 11 residues pruned to eliminate duplicates Z: 54 47.802 2.237 0.769 0.616 0.943 0.623 CB 1.576 54 residues pruned to eliminate duplicates Z: 37 36.953 2.267 0.715 0.604 0.917 0.722 CB 1.565 35 residues pruned to eliminate duplicates Z: 19 32.890 2.383 0.708 0.699 0.944 0.667 CB 1.682 19 residues pruned to eliminate duplicates Z: 36 38.458 2.334 0.668 0.628 0.914 0.714 CB 1.620 38 residues pruned to eliminate duplicates Z: 14 43.458 2.412 1.123 0.883 1.000 0.923 CA 1.702 14 residues pruned to eliminate duplicates Z: 32 33.430 2.368 0.633 0.584 0.871 0.677 CB 1.645 32 residues pruned to eliminate duplicates Z: 33 32.429 2.349 0.609 0.574 0.844 0.656 CB 1.674 33 residues pruned to eliminate duplicates Z: 37 38.396 2.277 0.607 0.600 0.944 0.667 CB 1.683 37 residues pruned to eliminate duplicates Z: 36 38.853 2.324 0.693 0.594 0.943 0.657 CB 1.617 36 residues pruned to eliminate duplicates Z: 27 29.511 2.286 0.648 0.632 0.846 0.692 CB 1.605 27 residues pruned to eliminate duplicates Z: 37 28.086 2.180 0.806 0.537 0.778 0.639 CB 1.475 37 residues pruned to eliminate duplicates Z: 36 40.417 2.336 0.698 0.606 0.943 0.714 CB 1.652 36 residues pruned to eliminate duplicates Z: 36 37.433 2.287 0.662 0.597 0.943 0.657 CB 1.610 36 residues pruned to eliminate duplicates Z: 36 42.249 2.306 0.745 0.629 0.943 0.714 CB 1.667 36 residues pruned to eliminate duplicates Z: 33 36.269 2.289 0.714 0.575 0.906 0.625 CB 1.677 33 residues pruned to eliminate duplicates Z: 30 40.229 2.376 0.667 0.648 0.931 0.690 CB 1.765 30 residues pruned to eliminate duplicates Z: 36 35.987 2.312 0.586 0.587 0.943 0.686 CB 1.619 36 residues pruned to eliminate duplicates Z: 36 38.802 2.348 0.607 0.616 0.943 0.657 CB 1.652 36 residues pruned to eliminate duplicates Z: 37 34.866 2.288 0.666 0.554 0.889 0.694 CB 1.626 37 residues pruned to eliminate duplicates Z: 34 25.301 2.192 0.520 0.477 0.909 0.545 CB 1.488 33 residues pruned to eliminate duplicates Z: 6 3.296 1.531 0.561 0.429 0.800 0.800 CA 0.830 6 residues pruned to eliminate duplicates Z: 14 16.967 2.158 0.760 0.399 0.846 0.615 CB 1.629 14 residues pruned to eliminate duplicates Z: 37 35.293 2.288 0.548 0.579 0.944 0.667 CB 1.630 37 residues pruned to eliminate duplicates Z: 6 3.286 1.860 0.558 0.454 0.800 0.600 CB 0.665 6 residues pruned to eliminate duplicates Z: 20 24.011 1.868 0.570 0.846 1.000 0.789 CB 1.396 20 residues pruned to eliminate duplicates Z: 18 22.695 2.010 0.434 0.867 1.000 0.882 CB 1.397 18 residues pruned to eliminate duplicates Z: 17 27.836 2.079 0.622 0.930 0.938 0.875 CB 1.540 17 residues pruned to eliminate duplicates Z: 16 30.646 2.084 0.658 0.926 1.000 0.800 CB 1.607 16 residues pruned to eliminate duplicates Z: 17 27.962 2.084 0.624 0.926 0.938 0.812 CB 1.545 17 residues pruned to eliminate duplicates Z: 17 27.904 2.088 0.621 0.921 0.938 0.812 CB 1.547 17 residues pruned to eliminate duplicates Z: 17 25.965 2.083 0.436 0.925 1.000 0.688 CB 1.523 17 residues pruned to eliminate duplicates Z: 19 20.675 1.922 0.506 0.829 0.889 0.611 CB 1.425 19 residues pruned to eliminate duplicates Z: 18 26.200 2.034 0.525 0.872 1.000 0.765 CB 1.494 18 residues pruned to eliminate duplicates Z: 17 28.106 2.086 0.647 0.923 0.938 0.875 CB 1.533 17 residues pruned to eliminate duplicates Z: 17 28.829 2.086 0.570 0.933 1.000 0.688 CB 1.536 17 residues pruned to eliminate duplicates Z: 16 27.450 2.083 0.482 0.917 1.000 0.800 CB 1.620 16 residues pruned to eliminate duplicates Z: 17 27.325 2.079 0.477 0.917 1.000 0.750 CB 1.570 17 residues pruned to eliminate duplicates Z: 17 26.187 2.081 0.562 0.913 0.938 0.812 CB 1.521 17 residues pruned to eliminate duplicates Z: 17 25.626 2.020 0.618 0.821 1.000 0.750 CB 1.484 17 residues pruned to eliminate duplicates Z: 17 20.491 1.986 0.364 0.815 0.938 0.688 CB 1.534 17 residues pruned to eliminate duplicates Z: 17 21.038 1.995 0.522 0.807 0.875 0.562 CB 1.515 17 residues pruned to eliminate duplicates Z: 31 23.125 1.964 0.515 0.625 0.967 0.700 CB 1.305 31 residues pruned to eliminate duplicates Z: 30 25.189 2.000 0.615 0.619 0.966 0.517 CB 1.340 30 residues pruned to eliminate duplicates Z: 29 24.909 1.951 0.554 0.672 0.964 0.643 CB 1.374 29 residues pruned to eliminate duplicates Z: 16 11.015 1.755 0.599 0.377 1.000 0.600 CB 1.157 16 residues pruned to eliminate duplicates Z: 13 13.192 1.990 0.468 0.459 1.000 0.583 CB 1.360 13 residues pruned to eliminate duplicates Z: 14 12.321 1.922 0.416 0.462 1.000 0.692 CB 1.305 14 residues pruned to eliminate duplicates Z: 6 4.488 1.701 0.614 0.348 0.800 0.600 CB 1.078 6 residues pruned to eliminate duplicates Z: 7 4.183 1.696 0.645 0.092 0.833 0.667 CB 1.241 8 residues pruned to eliminate duplicates Z: 8 11.576 2.029 0.390 0.554 1.000 0.714 CA 1.472 Z: 6 5.692 2.120 0.411 0.456 0.600 0.400 CB 1.483 6 residues pruned to eliminate duplicates Z: 27 33.717 2.374 0.853 0.467 0.885 0.423 CB 1.757 8 residues pruned to eliminate duplicates Z: 8 13.703 2.043 0.884 0.479 0.857 0.571 C 1.603 8 residues pruned to eliminate duplicates Z: 29 38.082 2.424 0.908 0.448 0.893 0.357 CA 1.838 27 residues pruned to eliminate duplicates Z: 26 32.472 2.420 0.860 0.456 0.880 0.440 CB 1.714 26 residues pruned to eliminate duplicates Z: 25 28.956 2.336 1.010 0.351 0.833 0.458 CA 1.774 25 residues pruned to eliminate duplicates Z: 11 9.746 1.910 0.871 0.424 0.700 0.200 CB 1.334 11 residues pruned to eliminate duplicates Z: 31 32.356 2.358 0.857 0.411 0.900 0.433 CB 1.645 31 residues pruned to eliminate duplicates Z: 30 35.962 2.403 0.944 0.421 0.897 0.483 CB 1.732 33 residues pruned to eliminate duplicates Z: 25 28.725 2.388 0.873 0.367 0.833 0.500 CB 1.814 25 residues pruned to eliminate duplicates Z: 14 12.831 2.105 0.740 0.372 0.769 0.462 CB 1.448 14 residues pruned to eliminate duplicates Z: 26 28.258 2.369 0.840 0.406 0.840 0.400 CB 1.704 26 residues pruned to eliminate duplicates Z: 8 9.911 2.203 0.793 0.266 0.857 0.143 CA 1.443 8 residues pruned to eliminate duplicates Z: 36 41.777 2.356 0.691 0.589 0.971 0.543 CB 1.675 36 residues pruned to eliminate duplicates Z: 15 13.810 2.042 0.655 0.345 0.929 0.357 CB 1.392 15 residues pruned to eliminate duplicates Z: 31 33.549 2.336 0.788 0.436 0.900 0.500 CB 1.741 53 residues pruned to eliminate duplicates Z: 42 43.237 2.285 0.661 0.785 0.878 0.683 CB 1.577 42 residues pruned to eliminate duplicates Z: 32 31.858 2.296 0.803 0.540 0.871 0.484 CB 1.526 32 residues pruned to eliminate duplicates Z: 25 46.704 2.358 0.882 0.740 0.917 0.792 CB 1.891 25 residues pruned to eliminate duplicates Z: 32 41.485 2.309 0.831 0.587 0.968 0.710 CB 1.675 32 residues pruned to eliminate duplicates Z: 30 38.395 2.377 0.682 0.613 0.897 0.621 CA 1.788 30 residues pruned to eliminate duplicates Z: 33 36.918 2.268 0.733 0.559 0.906 0.562 CB 1.731 33 residues pruned to eliminate duplicates Z: 56 52.363 2.344 0.717 0.623 0.982 0.673 CB 1.592 56 residues pruned to eliminate duplicates Z: 30 43.210 2.361 0.755 0.618 1.000 0.655 CB 1.732 30 residues pruned to eliminate duplicates Z: 41 51.081 2.381 0.655 0.752 1.000 0.750 CB 1.637 41 residues pruned to eliminate duplicates Z: 31 34.691 2.348 0.740 0.575 0.867 0.633 CB 1.664 31 residues pruned to eliminate duplicates Z: 27 39.319 2.360 0.894 0.668 0.885 0.692 CB 1.669 27 residues pruned to eliminate duplicates Z: 24 50.137 2.412 0.895 0.754 0.957 0.826 CB 1.908 24 residues pruned to eliminate duplicates Z: 32 36.626 2.334 0.674 0.561 1.000 0.677 CB 1.588 32 residues pruned to eliminate duplicates Z: 116 63.280 2.258 0.662 0.599 0.930 0.652 CB 1.538 123 residues pruned to eliminate duplicates Z: 51 45.037 2.322 0.557 0.644 0.960 0.700 CB 1.603 51 residues pruned to eliminate duplicates Z: 29 39.323 2.374 0.730 0.603 0.929 0.643 CB 1.766 29 residues pruned to eliminate duplicates Z: 120 60.991 2.245 0.660 0.593 0.908 0.655 CB 1.513 120 residues pruned to eliminate duplicates Z: 30 41.662 2.365 0.689 0.610 1.000 0.759 CB 1.745 30 residues pruned to eliminate duplicates Z: 30 36.496 2.346 0.576 0.601 0.966 0.690 CB 1.725 30 residues pruned to eliminate duplicates Z: 86 53.410 2.305 0.612 0.599 0.929 0.612 CB 1.526 86 residues pruned to eliminate duplicates Z: 68 44.653 2.262 0.590 0.612 0.940 0.657 CB 1.450 68 residues pruned to eliminate duplicates Z: 50 47.722 2.363 0.609 0.675 0.939 0.714 CB 1.625 50 residues pruned to eliminate duplicates Z: 89 54.879 2.270 0.674 0.591 0.920 0.580 CB 1.533 89 residues pruned to eliminate duplicates Z: 80 59.669 2.320 0.693 0.624 0.962 0.658 CB 1.581 80 residues pruned to eliminate duplicates Z: 26 31.744 2.275 0.538 0.782 0.920 0.600 CB 1.538 26 residues pruned to eliminate duplicates Z: 35 34.296 2.330 0.690 0.606 0.882 0.647 CB 1.531 35 residues pruned to eliminate duplicates Z: 57 42.575 2.336 0.541 0.595 0.946 0.607 CB 1.525 57 residues pruned to eliminate duplicates Z: 56 42.806 2.297 0.612 0.588 0.909 0.636 CB 1.576 56 residues pruned to eliminate duplicates Z: 59 46.032 2.312 0.725 0.568 0.931 0.586 CB 1.524 59 residues pruned to eliminate duplicates Z: 56 49.810 2.335 0.621 0.629 0.982 0.673 CB 1.600 56 residues pruned to eliminate duplicates Z: 95 60.422 2.308 0.714 0.581 0.926 0.628 CB 1.574 95 residues pruned to eliminate duplicates Z: 59 46.955 2.312 0.691 0.588 0.966 0.672 CB 1.501 59 residues pruned to eliminate duplicates Z: 59 43.077 2.346 0.601 0.572 0.914 0.552 CB 1.537 59 residues pruned to eliminate duplicates Z: 56 50.784 2.341 0.712 0.630 0.964 0.600 CB 1.569 56 residues pruned to eliminate duplicates Z: 27 31.708 2.335 0.769 0.635 0.923 0.654 CB 1.437 27 residues pruned to eliminate duplicates Z: 57 41.084 2.244 0.713 0.581 0.929 0.625 CB 1.423 57 residues pruned to eliminate duplicates Z: 57 48.655 2.336 0.691 0.615 0.946 0.679 CB 1.560 57 residues pruned to eliminate duplicates Z: 30 33.031 2.333 0.764 0.595 0.966 0.517 CB 1.410 30 residues pruned to eliminate duplicates Z: 51 43.320 2.325 0.668 0.625 0.940 0.700 CB 1.494 51 residues pruned to eliminate duplicates Z: 35 45.174 2.382 0.876 0.682 0.971 0.735 CB 1.511 35 residues pruned to eliminate duplicates Z: 83 56.003 2.313 0.651 0.607 0.939 0.634 CB 1.558 83 residues pruned to eliminate duplicates Z: 27 32.505 2.337 0.679 0.647 0.962 0.731 CB 1.473 27 residues pruned to eliminate duplicates Z: 86 52.102 2.236 0.661 0.610 0.918 0.659 CB 1.494 86 residues pruned to eliminate duplicates Z: 122 63.946 2.214 0.709 0.582 0.909 0.595 CB 1.562 122 residues pruned to eliminate duplicates Z: 55 54.315 2.380 0.702 0.630 0.981 0.648 CB 1.645 55 residues pruned to eliminate duplicates Z: 82 57.975 2.305 0.632 0.626 0.963 0.667 CB 1.580 82 residues pruned to eliminate duplicates Z: 80 58.459 2.337 0.662 0.634 0.949 0.709 CB 1.572 80 residues pruned to eliminate duplicates Z: 136 69.801 2.286 0.671 0.588 0.941 0.630 CB 1.537 136 residues pruned to eliminate duplicates Z: 114 65.911 2.246 0.677 0.624 0.938 0.699 CB 1.561 114 residues pruned to eliminate duplicates Z: 26 27.375 2.296 0.668 0.620 0.840 0.680 CB 1.521 26 residues pruned to eliminate duplicates Z: 80 54.509 2.340 0.562 0.630 0.924 0.658 CB 1.607 80 residues pruned to eliminate duplicates Z: 114 64.255 2.253 0.668 0.617 0.929 0.690 CB 1.549 114 residues pruned to eliminate duplicates Z: 118 56.356 2.202 0.601 0.585 0.923 0.667 CB 1.475 118 residues pruned to eliminate duplicates Z: 58 44.211 2.179 0.754 0.627 0.912 0.684 CB 1.490 58 residues pruned to eliminate duplicates Z: 53 46.969 2.320 0.756 0.623 0.942 0.615 CB 1.511 53 residues pruned to eliminate duplicates Z: 85 55.362 2.230 0.707 0.638 0.929 0.655 CB 1.501 85 residues pruned to eliminate duplicates Z: 103 62.556 2.276 0.779 0.614 0.922 0.657 CB 1.491 103 residues pruned to eliminate duplicates Z: 56 39.945 2.130 0.743 0.596 0.873 0.600 CB 1.517 56 residues pruned to eliminate duplicates Z: 86 56.522 2.241 0.788 0.608 0.929 0.671 CB 1.486 86 residues pruned to eliminate duplicates Z: 81 58.267 2.320 0.723 0.609 0.938 0.675 CB 1.568 81 residues pruned to eliminate duplicates Z: 85 60.440 2.285 0.725 0.636 0.940 0.690 CB 1.566 85 residues pruned to eliminate duplicates Z: 40 36.461 2.262 0.861 0.535 0.872 0.590 CB 1.537 40 residues pruned to eliminate duplicates Z: 71 58.051 2.379 0.672 0.616 0.971 0.643 CB 1.609 71 residues pruned to eliminate duplicates Z: 83 52.225 2.220 0.722 0.608 0.927 0.646 CB 1.469 83 residues pruned to eliminate duplicates Z: 113 65.446 2.239 0.765 0.600 0.920 0.616 CB 1.547 113 residues pruned to eliminate duplicates Z: 112 63.114 2.250 0.664 0.604 0.946 0.613 CB 1.532 112 residues pruned to eliminate duplicates Z: 63 43.197 2.231 0.797 0.547 0.903 0.597 CB 1.447 63 residues pruned to eliminate duplicates Z: 38 33.945 2.104 0.777 0.629 0.865 0.622 CB 1.528 38 residues pruned to eliminate duplicates Z: 149 74.226 2.284 0.743 0.582 0.919 0.615 CB 1.542 149 residues pruned to eliminate duplicates Z: 40 30.340 2.012 0.704 0.593 0.897 0.667 CB 1.445 40 residues pruned to eliminate duplicates Z: 39 32.750 2.091 0.668 0.630 0.921 0.711 CB 1.464 39 residues pruned to eliminate duplicates Z: 39 32.400 2.098 0.764 0.622 0.895 0.632 CB 1.414 39 residues pruned to eliminate duplicates Z: 38 31.916 2.081 0.750 0.614 0.892 0.622 CB 1.450 38 residues pruned to eliminate duplicates Z: 66 41.526 2.168 0.746 0.531 0.877 0.600 CB 1.505 66 residues pruned to eliminate duplicates Z: 17 20.960 2.039 1.215 0.441 0.875 0.500 CB 1.408 17 residues pruned to eliminate duplicates Z: 64 47.770 2.248 0.746 0.564 0.968 0.635 CB 1.488 64 residues pruned to eliminate duplicates Z: 16 25.364 2.160 1.123 0.456 0.933 0.533 CB 1.600 16 residues pruned to eliminate duplicates Z: 19 22.635 2.066 1.191 0.462 0.833 0.556 CB 1.471 19 residues pruned to eliminate duplicates Z: 19 18.942 2.060 0.811 0.436 0.889 0.500 CB 1.438 19 residues pruned to eliminate duplicates Z: 38 35.301 2.118 0.837 0.631 0.892 0.676 CB 1.479 38 residues pruned to eliminate duplicates Z: 31 33.528 2.109 0.842 0.702 0.900 0.800 CB 1.457 31 residues pruned to eliminate duplicates Z: 56 42.702 2.097 0.812 0.619 0.909 0.600 CB 1.490 56 residues pruned to eliminate duplicates Z: 67 50.603 2.247 0.812 0.585 0.894 0.530 CB 1.576 67 residues pruned to eliminate duplicates Z: 60 46.196 2.201 0.901 0.598 0.831 0.610 CB 1.575 60 residues pruned to eliminate duplicates Z: 59 49.021 2.233 0.819 0.591 0.879 0.741 CB 1.652 59 residues pruned to eliminate duplicates Z: 45 29.919 2.055 0.666 0.563 0.864 0.636 CB 1.435 45 residues pruned to eliminate duplicates Z: 38 31.559 2.083 0.823 0.611 0.865 0.622 CB 1.422 38 residues pruned to eliminate duplicates Z: 32 26.702 2.014 0.764 0.588 0.839 0.581 CB 1.480 32 residues pruned to eliminate duplicates Z: 29 28.070 2.032 0.779 0.621 0.964 0.464 CB 1.358 29 residues pruned to eliminate duplicates Z: 22 26.866 2.008 0.925 0.709 0.905 0.524 CB 1.387 22 residues pruned to eliminate duplicates Z: 39 34.063 2.072 0.915 0.641 0.895 0.658 CB 1.364 39 residues pruned to eliminate duplicates Z: 23 25.608 1.896 0.881 0.751 0.955 0.682 CB 1.283 23 residues pruned to eliminate duplicates Z: 37 32.006 2.106 0.817 0.634 0.861 0.556 CB 1.428 37 residues pruned to eliminate duplicates Z: 26 21.474 1.899 0.768 0.590 0.880 0.520 CB 1.333 26 residues pruned to eliminate duplicates Z: 21 25.784 2.025 0.921 0.716 0.900 0.450 CB 1.354 21 residues pruned to eliminate duplicates Z: 56 43.767 2.112 0.938 0.587 0.891 0.455 CB 1.488 56 residues pruned to eliminate duplicates Z: 37 33.660 2.085 0.942 0.611 0.889 0.472 CB 1.403 37 residues pruned to eliminate duplicates Z: 26 25.712 1.885 0.863 0.688 0.920 0.680 CB 1.339 26 residues pruned to eliminate duplicates Z: 67 50.855 2.246 0.847 0.574 0.909 0.545 CB 1.546 67 residues pruned to eliminate duplicates Z: 69 52.942 2.224 0.946 0.570 0.882 0.588 CB 1.572 69 residues pruned to eliminate duplicates Z: 25 34.454 2.396 0.848 0.574 0.875 0.542 CA 1.690 25 residues pruned to eliminate duplicates Z: 30 40.693 2.469 0.873 0.492 0.931 0.552 CB 1.769 30 residues pruned to eliminate duplicates Z: 55 48.404 2.206 0.959 0.611 0.889 0.537 CB 1.543 55 residues pruned to eliminate duplicates Z: 44 32.988 2.280 0.679 0.463 0.860 0.558 CB 1.586 44 residues pruned to eliminate duplicates Z: 33 30.960 2.366 0.588 0.468 0.875 0.531 CB 1.721 33 residues pruned to eliminate duplicates Z: 34 40.419 2.393 0.800 0.536 0.939 0.606 CB 1.679 34 residues pruned to eliminate duplicates Z: 24 45.333 2.456 0.981 0.577 1.000 0.565 CA 1.804 24 residues pruned to eliminate duplicates Z: 30 41.767 2.487 0.869 0.528 0.931 0.552 CB 1.743 30 residues pruned to eliminate duplicates Z: 32 37.194 2.356 0.752 0.512 0.871 0.548 CB 1.835 29 residues pruned to eliminate duplicates Z: 8 7.310 2.056 0.165 0.411 1.000 0.429 CB 1.267 8 residues pruned to eliminate duplicates Z: 30 38.684 2.430 0.843 0.505 0.966 0.483 CB 1.653 33 residues pruned to eliminate duplicates Z: 16 21.450 2.314 0.564 0.684 0.800 0.467 CA 1.615 16 residues pruned to eliminate duplicates Z: 32 35.622 2.439 0.683 0.494 0.903 0.419 CB 1.736 32 residues pruned to eliminate duplicates Z: 32 34.965 2.419 0.748 0.468 0.903 0.516 CB 1.698 32 residues pruned to eliminate duplicates Z: 20 46.113 2.580 0.889 0.618 1.000 0.632 CB 1.942 20 residues pruned to eliminate duplicates Z: 30 40.899 2.477 0.714 0.538 1.000 0.655 CB 1.723 30 residues pruned to eliminate duplicates Z: 32 36.476 2.422 0.721 0.484 0.935 0.516 CB 1.708 32 residues pruned to eliminate duplicates Z: 36 36.695 2.337 0.748 0.505 0.943 0.514 CB 1.603 36 residues pruned to eliminate duplicates Z: 36 41.164 2.348 0.859 0.505 0.914 0.600 CA 1.735 34 residues pruned to eliminate duplicates Z: 13 29.754 2.406 0.725 0.806 1.000 0.583 CA 1.584 13 residues pruned to eliminate duplicates Z: 30 36.617 2.460 0.821 0.481 0.862 0.655 CB 1.794 30 residues pruned to eliminate duplicates Z: 34 45.063 2.398 0.922 0.521 0.970 0.667 CB 1.719 36 residues pruned to eliminate duplicates Z: 13 35.231 2.595 0.835 0.660 1.000 0.750 CA 1.841 13 residues pruned to eliminate duplicates Z: 28 46.818 2.509 0.930 0.559 1.000 0.741 CB 1.758 29 residues pruned to eliminate duplicates Z: 6 7.008 1.833 0.747 0.456 1.000 0.800 CA 1.024 6 residues pruned to eliminate duplicates Z: 35 34.896 2.272 0.789 0.439 0.941 0.529 CB 1.666 35 residues pruned to eliminate duplicates Z: 34 38.451 2.380 0.869 0.507 0.879 0.697 CB 1.700 34 residues pruned to eliminate duplicates Z: 30 39.340 2.441 0.851 0.517 0.966 0.586 CB 1.645 29 residues pruned to eliminate duplicates Z: 16 41.850 2.366 1.072 0.819 0.933 0.667 CB 1.790 16 residues pruned to eliminate duplicates Z: 27 47.719 2.430 0.881 0.653 0.962 0.731 CB 1.848 27 residues pruned to eliminate duplicates Z: 15 44.705 2.556 1.078 0.852 0.929 0.857 CB 1.792 15 residues pruned to eliminate duplicates Z: 16 36.892 2.436 1.033 0.847 0.867 0.867 CB 1.648 16 residues pruned to eliminate duplicates Z: 17 36.436 2.505 1.138 0.755 0.812 0.750 CB 1.669 17 residues pruned to eliminate duplicates Z: 29 38.029 2.331 0.767 0.599 0.929 0.679 CB 1.709 29 residues pruned to eliminate duplicates Z: 29 37.044 2.315 0.840 0.585 0.929 0.821 CB 1.631 29 residues pruned to eliminate duplicates Z: 20 34.288 2.315 0.952 0.680 0.895 0.789 CB 1.649 20 residues pruned to eliminate duplicates Z: 29 49.880 2.409 0.850 0.645 1.000 0.786 CB 1.847 29 residues pruned to eliminate duplicates Z: 29 50.469 2.399 0.947 0.611 1.000 0.679 CB 1.837 29 residues pruned to eliminate duplicates Z: 29 38.687 2.341 0.845 0.593 0.893 0.714 CB 1.734 29 residues pruned to eliminate duplicates Z: 28 50.831 2.415 0.972 0.624 1.000 0.704 CB 1.827 28 residues pruned to eliminate duplicates Z: 20 40.182 2.328 1.017 0.734 0.947 0.632 CB 1.680 20 residues pruned to eliminate duplicates Z: 21 31.360 2.252 1.006 0.621 0.900 0.650 CB 1.539 21 residues pruned to eliminate duplicates Z: 26 56.848 2.500 1.000 0.674 1.000 0.760 CA 1.937 26 residues pruned to eliminate duplicates Z: 29 50.671 2.396 1.008 0.605 1.000 0.714 CB 1.800 29 residues pruned to eliminate duplicates Z: 29 47.750 2.393 0.905 0.604 1.000 0.714 CB 1.792 29 residues pruned to eliminate duplicates Z: 28 52.441 2.426 0.956 0.647 1.000 0.778 CB 1.854 28 residues pruned to eliminate duplicates Z: 30 47.164 2.338 0.992 0.601 0.966 0.690 CB 1.768 30 residues pruned to eliminate duplicates Z: 27 44.469 2.442 0.794 0.640 0.962 0.731 CA 1.815 27 residues pruned to eliminate duplicates Z: 28 49.466 2.446 0.884 0.643 0.963 0.778 CB 1.877 28 residues pruned to eliminate duplicates Z: 28 51.484 2.442 0.958 0.648 0.963 0.704 CB 1.874 27 residues pruned to eliminate duplicates Z: 6 5.218 1.752 0.807 0.297 0.800 0.400 CA 1.156 6 residues pruned to eliminate duplicates Z: 29 49.406 2.416 0.862 0.612 1.000 0.786 CB 1.866 29 residues pruned to eliminate duplicates Z: 28 37.807 2.372 0.667 0.602 0.926 0.704 CB 1.805 28 residues pruned to eliminate duplicates 721 residues left after pruning, divided into chains as follows: A: 10 B: 32 C: 17 D: 14 E: 16 F: 16 G: 47 H: 189 I: 30 J: 166 K: 19 L: 57 M: 97 N: 11 CC for partial structure against native data = 41.86 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 0.489, Connect. = 0.759 for dens.mod. cycle 1 = 0.300, Contrast = 0.561, Connect. = 0.784 for dens.mod. cycle 2 = 0.300, Contrast = 0.675, Connect. = 0.809 for dens.mod. cycle 3 = 0.300, Contrast = 0.689, Connect. = 0.812 for dens.mod. cycle 4 = 0.300, Contrast = 0.703, Connect. = 0.814 for dens.mod. cycle 5 = 0.300, Contrast = 0.710, Connect. = 0.815 for dens.mod. cycle 6 = 0.300, Contrast = 0.717, Connect. = 0.816 for dens.mod. cycle 7 = 0.300, Contrast = 0.721, Connect. = 0.817 for dens.mod. cycle 8 = 0.300, Contrast = 0.724, Connect. = 0.818 for dens.mod. cycle 9 = 0.300, Contrast = 0.725, Connect. = 0.818 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 4442 peaks > 0.5 sigma used to seed fragment search Space for about 1045 unique residues taking solvent into account 1034 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 17 35.589 2.265 0.908 0.795 0.938 0.750 CB 1.695 B: 15 44.808 2.438 0.932 0.945 1.000 0.929 CB 1.759 C: 15 37.349 2.442 0.690 0.915 1.000 0.786 CB 1.709 17 residues pruned to eliminate duplicates D: 14 40.699 2.321 1.118 0.933 1.000 0.846 CB 1.603 E: 26 25.087 2.327 0.708 0.337 0.880 0.480 CB 1.714 F: 20 53.584 2.497 0.894 0.925 1.000 0.842 CB 1.824 G: 36 54.694 2.362 0.792 0.863 1.000 0.600 CB 1.602 19 residues pruned to eliminate duplicates H: 14 57.060 2.559 1.308 0.947 1.000 0.846 CB 1.852 14 residues pruned to eliminate duplicates I: 14 23.536 2.325 0.449 0.814 0.923 0.615 CB 1.597 J: 19 32.905 2.121 0.998 0.813 0.944 0.556 CB 1.476 15 residues pruned to eliminate duplicates K: 16 51.112 2.352 1.235 0.925 0.933 0.867 CB 1.888 16 residues pruned to eliminate duplicates L: 15 49.136 2.415 1.177 0.900 1.000 0.786 CA 1.784 16 residues pruned to eliminate duplicates M: 15 29.883 2.359 0.805 0.773 0.857 0.429 CB 1.718 N: 12 31.319 2.474 0.826 0.804 0.909 0.545 CA 1.763 14 residues pruned to eliminate duplicates O: 20 44.908 2.441 0.709 0.921 1.000 0.842 CB 1.739 20 residues pruned to eliminate duplicates P: 16 35.732 2.317 0.807 0.794 1.000 0.733 CB 1.703 15 residues pruned to eliminate duplicates Q: 15 53.632 2.415 1.341 0.915 1.000 0.786 CB 1.793 15 residues pruned to eliminate duplicates R: 15 34.138 2.319 0.744 0.929 1.000 0.929 CB 1.579 15 residues pruned to eliminate duplicates S: 16 27.546 2.205 0.645 0.868 0.933 0.867 CB 1.535 16 residues pruned to eliminate duplicates T: 22 35.528 2.260 0.780 0.887 0.905 0.762 CB 1.536 U: 14 14.974 2.136 0.965 0.285 0.769 0.308 CB 1.638 V: 15 38.912 2.372 0.992 0.871 1.000 0.857 CA 1.605 15 residues pruned to eliminate duplicates W: 15 48.781 2.437 1.067 0.931 1.000 0.714 CB 1.808 14 residues pruned to eliminate duplicates X: 17 21.907 2.082 0.612 0.753 0.875 0.625 CA 1.488 17 residues pruned to eliminate duplicates Y: 15 33.969 2.337 0.661 0.937 1.000 0.857 CB 1.627 15 residues pruned to eliminate duplicates Z: 37 46.024 2.363 0.542 0.866 0.917 0.750 CB 1.682 37 residues pruned to eliminate duplicates Z: 21 45.810 2.376 0.730 0.900 1.000 0.800 CB 1.779 20 residues pruned to eliminate duplicates Z: 15 46.954 2.493 1.061 0.903 1.000 0.857 CB 1.741 15 residues pruned to eliminate duplicates Z: 59 41.842 2.202 0.636 0.562 0.879 0.707 CB 1.634 Z: 20 46.049 2.428 0.748 0.915 1.000 0.789 CB 1.759 20 residues pruned to eliminate duplicates Z: 22 26.679 2.304 0.831 0.404 0.905 0.476 CA 1.688 21 residues pruned to eliminate duplicates Z: 23 32.599 2.403 0.652 0.571 0.955 0.500 CA 1.712 11 residues pruned to eliminate duplicates Z: 27 39.675 2.449 0.688 0.546 0.962 0.615 CB 1.872 27 residues pruned to eliminate duplicates Z: 15 18.470 2.074 0.700 0.425 1.000 0.857 CB 1.514 Z: 18 27.301 1.961 0.586 0.909 1.000 0.588 CB 1.511 Z: 11 18.914 2.204 1.066 0.512 0.800 0.600 CB 1.623 11 residues pruned to eliminate duplicates Z: 16 51.412 2.322 1.387 0.912 0.933 0.600 CB 1.818 16 residues pruned to eliminate duplicates Z: 48 35.809 2.200 0.914 0.390 0.872 0.489 CB 1.597 42 residues pruned to eliminate duplicates Z: 29 36.661 2.473 0.878 0.426 0.893 0.500 CB 1.805 14 residues pruned to eliminate duplicates Z: 36 38.072 2.144 0.908 0.658 0.914 0.743 CB 1.486 Z: 12 25.629 2.377 0.550 0.744 0.909 0.545 CB 1.855 12 residues pruned to eliminate duplicates Z: 13 30.168 2.427 0.682 0.865 0.917 0.917 CA 1.705 13 residues pruned to eliminate duplicates Z: 93 68.296 2.309 0.817 0.619 0.957 0.663 CB 1.585 81 residues pruned to eliminate duplicates Z: 10 22.686 2.347 0.419 0.839 1.000 0.556 CB 1.696 Z: 29 37.332 2.407 0.567 0.550 1.000 0.643 CB 1.781 28 residues pruned to eliminate duplicates Z: 15 28.689 2.379 0.730 0.803 0.857 0.643 CB 1.668 15 residues pruned to eliminate duplicates Z: 19 16.660 2.221 0.530 0.453 0.833 0.556 CB 1.454 Z: 93 53.835 2.268 0.647 0.602 0.924 0.630 CB 1.475 71 residues pruned to eliminate duplicates Z: 12 25.206 2.418 0.569 0.801 0.909 0.636 CA 1.694 12 residues pruned to eliminate duplicates Z: 19 21.049 2.313 0.673 0.448 0.889 0.611 CB 1.522 18 residues pruned to eliminate duplicates Z: 7 9.252 1.927 0.724 0.597 0.667 0.667 CB 1.555 Z: 21 40.764 2.208 1.119 0.903 0.900 0.650 CB 1.543 22 residues pruned to eliminate duplicates Z: 10 26.888 2.335 0.639 0.819 1.000 0.778 CA 1.775 10 residues pruned to eliminate duplicates Z: 21 23.296 1.959 0.732 0.544 1.000 0.700 CB 1.470 Z: 15 26.427 2.290 0.371 0.934 1.000 1.000 CB 1.569 15 residues pruned to eliminate duplicates Z: 26 52.302 2.469 0.895 0.676 1.000 0.760 CB 1.901 15 residues pruned to eliminate duplicates Z: 19 47.445 2.419 0.967 0.891 0.944 0.889 CB 1.789 19 residues pruned to eliminate duplicates Z: 39 50.717 2.307 0.694 0.863 0.921 0.711 CB 1.677 39 residues pruned to eliminate duplicates Z: 15 21.902 2.171 0.613 0.774 0.857 0.714 CB 1.531 10 residues pruned to eliminate duplicates Z: 15 28.148 2.317 0.661 0.839 1.000 0.786 CB 1.460 Z: 11 22.743 2.607 0.535 0.842 0.700 0.700 CB 1.914 11 residues pruned to eliminate duplicates Z: 15 20.105 2.233 0.497 0.783 0.857 0.714 CB 1.461 15 residues pruned to eliminate duplicates Z: 17 44.055 2.214 1.288 0.882 0.938 0.688 CB 1.677 17 residues pruned to eliminate duplicates Z: 58 45.407 2.219 0.808 0.596 0.912 0.474 CB 1.500 22 residues pruned to eliminate duplicates Z: 16 37.540 2.343 0.792 0.909 0.933 0.800 CA 1.755 16 residues pruned to eliminate duplicates Z: 16 38.779 2.371 0.827 0.899 1.000 0.867 CB 1.652 16 residues pruned to eliminate duplicates Z: 15 47.321 2.448 1.149 0.937 0.929 0.786 CB 1.802 15 residues pruned to eliminate duplicates Z: 14 38.714 2.452 0.700 0.928 1.000 0.923 CB 1.803 14 residues pruned to eliminate duplicates Z: 14 44.936 2.441 0.986 0.928 1.000 0.923 CB 1.800 15 residues pruned to eliminate duplicates Z: 16 26.986 2.297 0.657 0.743 0.867 0.533 CB 1.699 16 residues pruned to eliminate duplicates Z: 16 39.302 2.335 0.906 0.872 0.933 0.800 CA 1.780 16 residues pruned to eliminate duplicates Z: 29 31.044 2.397 0.814 0.413 0.857 0.429 CB 1.724 29 residues pruned to eliminate duplicates Z: 14 15.049 2.221 0.891 0.391 0.846 0.385 CB 1.319 14 residues pruned to eliminate duplicates Z: 18 21.700 2.133 0.898 0.504 0.882 0.588 CB 1.467 18 residues pruned to eliminate duplicates Z: 20 48.167 2.450 0.839 0.911 1.000 0.842 CB 1.738 20 residues pruned to eliminate duplicates Z: 13 7.662 1.821 0.420 0.301 0.750 0.583 CB 1.424 13 residues pruned to eliminate duplicates Z: 13 43.405 2.509 0.914 0.936 1.000 0.917 CB 1.816 13 residues pruned to eliminate duplicates Z: 40 28.831 2.096 0.699 0.577 0.897 0.564 CB 1.342 19 residues pruned to eliminate duplicates Z: 13 25.639 2.090 0.810 0.887 0.917 0.917 CB 1.538 13 residues pruned to eliminate duplicates Z: 19 49.213 2.457 0.836 0.933 1.000 0.889 CB 1.794 19 residues pruned to eliminate duplicates Z: 11 7.895 2.153 0.537 0.267 0.700 0.300 CB 1.406 Z: 17 33.683 2.273 0.917 0.852 0.875 0.812 CA 1.635 17 residues pruned to eliminate duplicates Z: 16 27.871 2.149 0.722 0.820 0.933 0.733 CB 1.578 Z: 27 27.982 2.342 0.870 0.410 0.923 0.538 CB 1.493 21 residues pruned to eliminate duplicates Z: 12 20.916 2.264 0.411 0.852 0.909 0.909 CB 1.607 12 residues pruned to eliminate duplicates Z: 15 30.127 2.272 0.839 0.799 0.929 0.571 CA 1.597 15 residues pruned to eliminate duplicates Z: 32 36.235 2.414 0.704 0.515 0.935 0.581 CB 1.665 32 residues pruned to eliminate duplicates Z: 31 33.242 2.340 0.696 0.473 0.900 0.633 CB 1.747 31 residues pruned to eliminate duplicates Z: 23 34.109 2.421 0.739 0.595 0.909 0.636 CB 1.736 23 residues pruned to eliminate duplicates Z: 12 16.448 1.967 1.145 0.502 0.818 0.545 CB 1.434 2 residues pruned to eliminate duplicates Z: 14 51.596 2.475 1.186 0.943 1.000 0.846 CB 1.833 14 residues pruned to eliminate duplicates Z: 16 12.397 1.984 0.354 0.433 1.000 0.733 CB 1.277 16 residues pruned to eliminate duplicates Z: 11 23.603 2.390 0.500 0.871 0.900 0.700 CA 1.687 11 residues pruned to eliminate duplicates Z: 23 15.147 2.279 0.620 0.288 0.773 0.318 CB 1.437 23 residues pruned to eliminate duplicates Z: 30 40.265 2.427 0.696 0.545 0.931 0.586 CB 1.867 30 residues pruned to eliminate duplicates Z: 12 8.902 2.116 0.717 0.260 0.727 0.273 CB 1.337 12 residues pruned to eliminate duplicates Z: 15 29.545 2.297 0.865 0.792 0.929 0.786 CB 1.536 15 residues pruned to eliminate duplicates Z: 14 31.351 2.203 0.797 0.932 1.000 0.923 CB 1.533 Z: 17 30.378 2.034 0.821 0.911 0.938 0.750 CB 1.550 17 residues pruned to eliminate duplicates Z: 35 36.478 2.336 0.596 0.596 0.912 0.706 CB 1.678 14 residues pruned to eliminate duplicates Z: 17 23.990 2.018 0.306 0.932 1.000 0.875 CA 1.589 17 residues pruned to eliminate duplicates Z: 19 40.202 2.374 0.678 0.929 0.944 0.889 CB 1.762 19 residues pruned to eliminate duplicates Z: 17 22.043 2.022 0.229 0.914 1.000 1.000 CB 1.568 17 residues pruned to eliminate duplicates Z: 17 19.781 2.147 0.864 0.408 1.000 0.750 CB 1.360 17 residues pruned to eliminate duplicates Z: 30 34.800 2.317 0.877 0.440 0.931 0.448 CB 1.697 30 residues pruned to eliminate duplicates Z: 20 22.169 2.025 0.385 0.855 0.947 0.579 CB 1.413 20 residues pruned to eliminate duplicates Z: 16 24.750 2.229 0.535 0.873 0.933 0.867 CB 1.457 16 residues pruned to eliminate duplicates Z: 36 34.632 2.114 0.541 0.878 0.971 0.800 CB 1.343 21 residues pruned to eliminate duplicates Z: 16 17.812 2.318 0.537 0.478 0.867 0.667 CB 1.523 16 residues pruned to eliminate duplicates Z: 29 29.915 2.291 0.783 0.495 0.857 0.607 CB 1.623 29 residues pruned to eliminate duplicates Z: 6 4.119 1.741 0.536 0.456 0.800 0.600 CA 0.901 6 residues pruned to eliminate duplicates Z: 14 48.237 2.428 1.188 0.944 1.000 0.769 CB 1.745 14 residues pruned to eliminate duplicates Z: 18 32.288 1.986 1.014 0.926 1.000 0.647 CB 1.374 18 residues pruned to eliminate duplicates Z: 15 25.548 2.050 1.102 0.780 0.929 0.643 CB 1.333 15 residues pruned to eliminate duplicates Z: 18 31.922 2.035 1.033 0.909 0.882 0.529 CB 1.506 18 residues pruned to eliminate duplicates Z: 35 33.783 2.137 0.556 0.812 0.941 0.647 CB 1.411 35 residues pruned to eliminate duplicates Z: 26 31.976 2.394 0.804 0.412 0.920 0.480 CB 1.766 26 residues pruned to eliminate duplicates Z: 25 25.294 2.080 0.850 0.553 0.917 0.708 CB 1.390 Z: 34 37.934 2.191 0.681 0.863 0.909 0.606 CB 1.447 33 residues pruned to eliminate duplicates Z: 33 34.980 2.310 0.632 0.502 0.938 0.656 CB 1.747 30 residues pruned to eliminate duplicates Z: 21 45.050 2.380 0.764 0.918 1.000 0.850 CA 1.692 21 residues pruned to eliminate duplicates Z: 17 25.946 2.020 0.410 0.943 1.000 1.000 CA 1.578 17 residues pruned to eliminate duplicates Z: 37 46.895 2.376 0.478 0.872 0.972 0.806 CB 1.668 37 residues pruned to eliminate duplicates Z: 26 25.348 2.035 0.923 0.530 0.920 0.600 CB 1.368 25 residues pruned to eliminate duplicates Z: 16 24.663 2.197 0.430 0.845 1.000 0.867 CA 1.507 15 residues pruned to eliminate duplicates Z: 13 21.512 2.339 0.764 0.746 0.833 0.583 CB 1.450 13 residues pruned to eliminate duplicates Z: 19 17.409 2.295 0.568 0.384 0.833 0.556 CB 1.548 19 residues pruned to eliminate duplicates Z: 146 64.036 2.192 0.828 0.513 0.855 0.559 CB 1.533 96 residues pruned to eliminate duplicates Z: 13 26.024 2.081 0.899 0.734 0.917 0.583 CB 1.680 13 residues pruned to eliminate duplicates Z: 44 29.485 2.050 0.772 0.567 0.860 0.651 CB 1.348 40 residues pruned to eliminate duplicates Z: 37 47.564 2.347 0.534 0.856 0.972 0.806 CB 1.670 37 residues pruned to eliminate duplicates Z: 15 33.507 2.374 0.489 0.916 1.000 0.857 CB 1.789 15 residues pruned to eliminate duplicates Z: 17 12.594 1.853 0.604 0.539 0.750 0.625 CB 1.360 17 residues pruned to eliminate duplicates Z: 22 37.851 2.477 0.475 0.877 0.952 0.857 CB 1.725 22 residues pruned to eliminate duplicates Z: 28 50.081 2.387 0.920 0.678 1.000 0.815 CB 1.786 27 residues pruned to eliminate duplicates Z: 14 11.724 1.903 0.255 0.894 0.923 0.769 CB 1.058 14 residues pruned to eliminate duplicates Z: 11 22.805 2.220 0.941 0.597 0.900 0.800 CB 1.694 11 residues pruned to eliminate duplicates Z: 77 56.458 2.276 0.751 0.595 0.961 0.684 CB 1.544 77 residues pruned to eliminate duplicates Z: 13 36.804 2.506 0.890 0.917 0.917 0.667 CB 1.726 13 residues pruned to eliminate duplicates Z: 11 28.650 2.418 0.771 0.868 1.000 0.800 CB 1.546 11 residues pruned to eliminate duplicates Z: 15 16.350 2.068 0.608 0.422 1.000 0.714 CB 1.425 15 residues pruned to eliminate duplicates Z: 8 31.091 2.649 0.619 0.863 1.000 0.857 CB 2.010 8 residues pruned to eliminate duplicates Z: 14 25.009 2.105 0.580 0.928 0.923 0.692 CB 1.583 14 residues pruned to eliminate duplicates Z: 37 37.354 2.274 0.652 0.614 0.944 0.722 CB 1.574 35 residues pruned to eliminate duplicates Z: 15 25.203 2.184 0.432 0.837 1.000 0.857 CA 1.610 15 residues pruned to eliminate duplicates Z: 84 44.631 2.132 0.633 0.583 0.892 0.614 CB 1.457 71 residues pruned to eliminate duplicates Z: 15 39.008 2.274 1.127 0.929 1.000 0.643 CB 1.508 15 residues pruned to eliminate duplicates Z: 37 35.714 2.110 0.620 0.871 0.917 0.806 CB 1.386 37 residues pruned to eliminate duplicates Z: 37 46.501 2.352 0.545 0.861 0.972 0.722 CB 1.612 37 residues pruned to eliminate duplicates Z: 14 48.839 2.503 1.265 0.863 1.000 0.615 CB 1.752 26 residues pruned to eliminate duplicates Z: 13 21.271 1.983 0.913 0.892 0.750 0.500 CA 1.551 13 residues pruned to eliminate duplicates Z: 18 17.047 1.948 0.490 0.728 0.941 0.647 CB 1.233 18 residues pruned to eliminate duplicates Z: 8 27.797 2.606 0.484 0.905 1.000 0.857 CA 1.933 8 residues pruned to eliminate duplicates Z: 34 46.731 2.406 0.568 0.836 0.970 0.727 CB 1.664 34 residues pruned to eliminate duplicates Z: 13 28.303 2.392 0.691 0.665 0.917 0.500 CB 1.892 13 residues pruned to eliminate duplicates Z: 15 36.066 2.396 0.716 0.866 1.000 0.857 CA 1.717 15 residues pruned to eliminate duplicates Z: 13 14.554 1.986 0.664 0.430 1.000 0.667 CB 1.367 Z: 16 28.412 2.118 0.503 0.938 1.000 0.933 CB 1.603 17 residues pruned to eliminate duplicates Z: 15 17.585 2.083 0.740 0.439 0.929 0.786 CB 1.488 15 residues pruned to eliminate duplicates Z: 17 28.602 2.031 0.610 0.918 1.000 0.562 CB 1.542 17 residues pruned to eliminate duplicates Z: 70 48.508 2.200 0.820 0.558 0.870 0.551 CB 1.584 71 residues pruned to eliminate duplicates Z: 18 17.563 2.013 0.816 0.422 0.882 0.471 CB 1.432 18 residues pruned to eliminate duplicates Z: 15 40.075 2.319 1.047 0.943 1.000 0.929 CB 1.564 15 residues pruned to eliminate duplicates Z: 31 27.025 2.269 0.678 0.610 0.867 0.667 CB 1.347 31 residues pruned to eliminate duplicates Z: 16 37.715 2.320 0.852 0.763 1.000 0.600 CB 1.795 16 residues pruned to eliminate duplicates Z: 15 30.654 2.084 0.777 0.921 1.000 0.857 CB 1.556 14 residues pruned to eliminate duplicates Z: 17 31.206 2.025 0.796 0.945 0.938 0.688 CB 1.584 18 residues pruned to eliminate duplicates Z: 24 29.453 2.329 0.550 0.644 0.913 0.652 CB 1.629 24 residues pruned to eliminate duplicates Z: 48 28.406 1.925 0.648 0.565 0.936 0.638 CB 1.309 48 residues pruned to eliminate duplicates Z: 37 32.363 2.072 0.546 0.832 0.917 0.750 CB 1.379 37 residues pruned to eliminate duplicates Z: 15 12.995 1.968 0.449 0.472 0.929 0.571 CB 1.350 15 residues pruned to eliminate duplicates Z: 16 34.656 2.222 1.235 0.851 0.933 0.800 CB 1.429 16 residues pruned to eliminate duplicates Z: 63 52.814 2.378 0.638 0.576 0.919 0.661 CB 1.741 89 residues pruned to eliminate duplicates Z: 21 34.686 2.273 0.726 0.886 0.900 0.800 CB 1.586 21 residues pruned to eliminate duplicates Z: 15 11.605 1.795 0.177 0.895 0.929 0.786 CB 1.133 15 residues pruned to eliminate duplicates Z: 26 25.649 2.059 0.919 0.510 0.920 0.640 CB 1.397 26 residues pruned to eliminate duplicates Z: 25 28.393 2.064 0.841 0.563 1.000 0.708 CB 1.436 26 residues pruned to eliminate duplicates Z: 17 30.746 2.057 0.766 0.938 1.000 0.688 CB 1.472 17 residues pruned to eliminate duplicates Z: 46 35.016 2.219 0.799 0.468 0.844 0.489 CB 1.599 49 residues pruned to eliminate duplicates Z: 17 21.035 2.155 0.602 0.489 1.000 0.812 CA 1.541 17 residues pruned to eliminate duplicates Z: 17 27.822 1.985 0.645 0.921 0.938 0.500 CB 1.599 17 residues pruned to eliminate duplicates Z: 9 14.253 2.235 0.426 0.712 0.875 0.375 CB 1.492 9 residues pruned to eliminate duplicates Z: 13 11.400 2.120 0.241 0.499 0.917 0.500 CA 1.366 13 residues pruned to eliminate duplicates Z: 16 26.613 2.106 0.902 0.798 0.933 0.733 CB 1.416 16 residues pruned to eliminate duplicates Z: 14 28.654 2.203 0.653 0.918 1.000 0.923 CB 1.539 14 residues pruned to eliminate duplicates Z: 15 15.806 2.295 0.501 0.453 0.857 0.500 CB 1.502 15 residues pruned to eliminate duplicates Z: 22 34.994 2.123 0.798 0.891 1.000 0.714 CB 1.438 22 residues pruned to eliminate duplicates Z: 15 29.298 2.191 0.667 0.932 1.000 0.857 CB 1.497 15 residues pruned to eliminate duplicates Z: 13 20.413 2.221 0.417 0.843 0.917 0.917 CA 1.522 13 residues pruned to eliminate duplicates Z: 6 7.864 1.924 0.579 0.618 0.800 0.400 CB 1.294 6 residues pruned to eliminate duplicates Z: 35 38.239 2.144 0.805 0.590 0.941 0.618 CB 1.652 35 residues pruned to eliminate duplicates Z: 14 13.130 1.944 0.549 0.494 0.923 0.615 CB 1.317 14 residues pruned to eliminate duplicates Z: 11 16.402 2.129 0.880 0.876 0.900 0.700 CB 1.046 11 residues pruned to eliminate duplicates Z: 13 18.452 2.061 0.723 0.496 1.000 0.667 CB 1.507 Z: 15 28.930 2.202 0.810 0.817 0.929 0.571 CB 1.587 16 residues pruned to eliminate duplicates Z: 18 25.440 2.087 0.323 0.911 1.000 0.824 CB 1.584 18 residues pruned to eliminate duplicates Z: 17 32.249 2.011 0.919 0.917 1.000 0.812 CB 1.475 17 residues pruned to eliminate duplicates Z: 15 19.438 1.990 0.783 0.508 1.000 0.643 CB 1.452 14 residues pruned to eliminate duplicates Z: 26 54.563 2.476 0.926 0.712 1.000 0.640 CB 1.888 26 residues pruned to eliminate duplicates Z: 7 6.198 1.850 -0.090 0.667 1.000 0.500 CB 1.288 Z: 15 31.799 2.251 0.784 0.831 1.000 0.500 CB 1.590 15 residues pruned to eliminate duplicates Z: 13 25.423 2.083 0.797 0.896 0.917 0.750 CA 1.533 13 residues pruned to eliminate duplicates Z: 16 30.987 1.968 0.895 0.931 1.000 0.867 CB 1.499 16 residues pruned to eliminate duplicates Z: 38 31.463 2.098 0.693 0.630 0.919 0.703 CB 1.402 38 residues pruned to eliminate duplicates Z: 61 48.875 2.209 0.978 0.566 0.850 0.533 CB 1.594 61 residues pruned to eliminate duplicates Z: 29 28.234 2.279 0.689 0.427 0.893 0.571 CB 1.674 29 residues pruned to eliminate duplicates Z: 12 26.131 2.197 0.686 0.929 1.000 0.909 CB 1.489 12 residues pruned to eliminate duplicates Z: 17 37.933 2.221 0.979 0.786 0.938 0.562 CA 1.790 17 residues pruned to eliminate duplicates Z: 26 21.365 2.210 0.560 0.427 0.880 0.560 CB 1.520 26 residues pruned to eliminate duplicates Z: 14 23.467 2.047 1.090 0.845 0.923 0.615 CB 1.225 14 residues pruned to eliminate duplicates Z: 15 33.572 2.245 0.857 0.838 1.000 0.714 CB 1.609 15 residues pruned to eliminate duplicates Z: 26 34.589 2.387 0.831 0.477 0.920 0.440 CB 1.761 25 residues pruned to eliminate duplicates Z: 27 34.247 2.316 0.866 0.502 0.923 0.692 CB 1.680 27 residues pruned to eliminate duplicates Z: 36 32.142 2.145 0.652 0.633 0.914 0.714 CB 1.480 36 residues pruned to eliminate duplicates Z: 35 35.713 2.120 0.753 0.628 0.941 0.735 CB 1.551 35 residues pruned to eliminate duplicates Z: 15 41.121 2.325 1.067 0.936 1.000 0.857 CB 1.592 15 residues pruned to eliminate duplicates Z: 30 42.553 2.354 0.770 0.657 0.966 0.621 CB 1.699 30 residues pruned to eliminate duplicates Z: 56 51.130 2.186 0.804 0.666 0.927 0.691 CB 1.617 56 residues pruned to eliminate duplicates Z: 11 4.606 1.679 0.343 0.204 0.700 0.300 CA 1.310 11 residues pruned to eliminate duplicates Z: 14 40.160 2.380 1.101 0.888 0.923 0.692 CB 1.739 14 residues pruned to eliminate duplicates Z: 17 24.212 2.005 0.418 0.903 1.000 0.625 CA 1.518 17 residues pruned to eliminate duplicates Z: 27 36.220 2.452 0.636 0.650 0.885 0.731 CB 1.740 27 residues pruned to eliminate duplicates Z: 6 6.163 1.919 0.093 0.763 0.800 0.200 CA 1.301 6 residues pruned to eliminate duplicates Z: 17 28.006 2.053 0.680 0.918 1.000 0.688 CB 1.432 17 residues pruned to eliminate duplicates Z: 68 53.117 2.234 0.896 0.590 0.985 0.552 CB 1.427 54 residues pruned to eliminate duplicates Z: 17 22.378 1.957 0.459 0.926 0.938 0.938 CB 1.466 17 residues pruned to eliminate duplicates Z: 20 36.216 1.952 1.101 0.861 1.000 0.737 CB 1.488 20 residues pruned to eliminate duplicates Z: 15 28.543 2.119 0.601 0.944 1.000 0.929 CB 1.558 15 residues pruned to eliminate duplicates Z: 11 18.971 2.042 1.039 0.547 0.900 0.800 CB 1.530 11 residues pruned to eliminate duplicates Z: 20 22.399 1.958 0.383 0.911 0.947 0.842 CA 1.419 20 residues pruned to eliminate duplicates Z: 21 39.598 2.286 0.883 0.892 0.950 0.750 CB 1.556 21 residues pruned to eliminate duplicates Z: 99 48.849 2.145 0.728 0.554 0.898 0.633 CB 1.406 99 residues pruned to eliminate duplicates Z: 33 37.070 2.384 0.818 0.465 0.906 0.469 CB 1.730 33 residues pruned to eliminate duplicates Z: 15 24.959 2.168 0.509 0.807 1.000 0.643 CB 1.560 15 residues pruned to eliminate duplicates Z: 37 46.806 2.346 0.560 0.873 0.972 0.722 CB 1.597 37 residues pruned to eliminate duplicates Z: 72 36.648 2.067 0.735 0.558 0.873 0.606 CB 1.313 74 residues pruned to eliminate duplicates Z: 11 21.643 2.224 0.502 0.836 0.900 0.700 CB 1.705 11 residues pruned to eliminate duplicates Z: 10 22.174 2.138 0.959 0.653 0.889 0.778 CB 1.723 10 residues pruned to eliminate duplicates Z: 9 5.035 1.846 0.047 0.636 0.875 0.500 CB 0.927 7 residues pruned to eliminate duplicates Z: 14 8.502 1.899 0.816 0.393 0.769 0.538 CB 0.996 14 residues pruned to eliminate duplicates Z: 16 25.226 2.087 0.518 0.813 1.000 0.733 CB 1.565 16 residues pruned to eliminate duplicates Z: 14 21.357 1.920 0.741 0.837 0.923 0.769 CB 1.436 14 residues pruned to eliminate duplicates Z: 13 23.630 2.064 0.593 0.893 1.000 0.833 CB 1.489 13 residues pruned to eliminate duplicates Z: 33 24.928 2.009 0.511 0.588 0.906 0.750 CB 1.473 33 residues pruned to eliminate duplicates Z: 18 22.488 1.916 0.305 0.928 1.000 0.941 CB 1.526 18 residues pruned to eliminate duplicates Z: 18 25.295 2.012 0.692 0.798 0.941 0.706 CA 1.475 18 residues pruned to eliminate duplicates Z: 30 40.079 2.434 0.705 0.575 1.000 0.793 CB 1.668 30 residues pruned to eliminate duplicates Z: 11 3.098 1.836 -0.183 0.409 0.800 0.400 CB 0.898 Z: 13 19.963 2.146 0.801 0.448 0.917 0.500 CB 1.715 13 residues pruned to eliminate duplicates Z: 25 23.146 2.028 0.701 0.520 0.958 0.583 CB 1.401 25 residues pruned to eliminate duplicates Z: 11 22.993 1.991 0.770 0.884 1.000 0.800 CB 1.491 11 residues pruned to eliminate duplicates Z: 35 34.256 2.338 0.602 0.558 0.941 0.676 CB 1.576 35 residues pruned to eliminate duplicates Z: 25 32.160 2.367 0.735 0.544 0.917 0.667 CB 1.669 25 residues pruned to eliminate duplicates Z: 15 11.035 1.809 0.038 0.908 1.000 0.786 CB 1.116 15 residues pruned to eliminate duplicates Z: 9 16.465 2.058 0.586 0.784 1.000 0.625 CB 1.389 10 residues pruned to eliminate duplicates Z: 15 21.103 2.402 0.569 0.619 0.857 0.714 CA 1.561 15 residues pruned to eliminate duplicates Z: 42 38.117 2.107 1.085 0.618 0.878 0.634 CB 1.381 42 residues pruned to eliminate duplicates Z: 15 24.942 2.127 0.434 0.812 1.000 0.857 CA 1.665 15 residues pruned to eliminate duplicates Z: 16 22.442 2.027 0.630 0.868 0.933 0.600 CB 1.373 16 residues pruned to eliminate duplicates Z: 43 37.790 2.302 0.916 0.461 0.857 0.524 CB 1.606 30 residues pruned to eliminate duplicates Z: 20 32.162 2.163 0.615 0.915 0.947 0.947 CB 1.576 20 residues pruned to eliminate duplicates Z: 13 13.729 1.941 0.528 0.871 1.000 0.750 CB 0.974 13 residues pruned to eliminate duplicates Z: 12 25.509 2.175 0.799 0.827 0.909 0.636 CB 1.629 12 residues pruned to eliminate duplicates Z: 15 29.328 2.107 0.764 0.938 1.000 0.786 CB 1.467 15 residues pruned to eliminate duplicates Z: 16 29.401 2.221 0.918 0.814 0.867 0.600 CB 1.565 16 residues pruned to eliminate duplicates Z: 65 44.967 2.247 0.633 0.611 0.969 0.672 CB 1.424 65 residues pruned to eliminate duplicates Z: 11 14.649 1.885 0.701 0.586 0.900 0.700 CA 1.478 12 residues pruned to eliminate duplicates Z: 20 35.241 2.166 0.871 0.866 0.947 0.684 CB 1.542 20 residues pruned to eliminate duplicates Z: 21 32.918 2.396 0.653 0.556 0.950 0.700 CB 1.851 21 residues pruned to eliminate duplicates Z: 17 30.602 2.231 0.643 0.861 0.938 0.875 CA 1.636 17 residues pruned to eliminate duplicates Z: 14 30.138 2.344 0.774 0.840 0.923 0.923 CB 1.625 14 residues pruned to eliminate duplicates Z: 15 9.334 1.960 0.656 0.465 0.857 0.643 CB 0.929 15 residues pruned to eliminate duplicates Z: 9 10.355 2.020 0.621 0.746 0.750 0.500 CB 1.197 9 residues pruned to eliminate duplicates Z: 9 14.344 2.060 0.603 0.808 0.875 0.625 CB 1.342 9 residues pruned to eliminate duplicates Z: 13 22.809 2.077 0.511 0.836 1.000 0.750 CA 1.570 13 residues pruned to eliminate duplicates Z: 17 31.883 2.003 0.979 0.946 1.000 0.625 CB 1.391 17 residues pruned to eliminate duplicates Z: 9 18.682 2.333 0.892 0.444 0.875 0.625 CB 1.811 9 residues pruned to eliminate duplicates Z: 30 19.312 2.249 0.701 0.321 0.793 0.483 CB 1.440 30 residues pruned to eliminate duplicates Z: 13 26.477 2.295 0.492 0.846 1.000 0.917 CB 1.659 13 residues pruned to eliminate duplicates Z: 11 11.691 2.036 0.511 0.339 0.900 0.600 C 1.591 11 residues pruned to eliminate duplicates Z: 15 26.340 2.249 0.434 0.901 1.000 0.857 CB 1.558 15 residues pruned to eliminate duplicates Z: 23 40.940 2.440 0.951 0.669 0.864 0.682 CB 1.816 23 residues pruned to eliminate duplicates Z: 15 57.245 2.453 1.498 0.883 1.000 0.929 CB 1.804 15 residues pruned to eliminate duplicates Z: 20 15.642 1.868 0.590 0.767 0.842 0.579 CB 1.132 20 residues pruned to eliminate duplicates Z: 29 16.805 1.818 0.540 0.486 0.929 0.607 CB 1.239 28 residues pruned to eliminate duplicates Z: 17 17.241 1.958 0.699 0.452 0.938 0.500 CA 1.451 Z: 16 24.031 2.041 0.401 0.934 1.000 0.933 CB 1.513 16 residues pruned to eliminate duplicates Z: 29 32.429 2.171 1.050 0.545 0.893 0.500 CB 1.477 29 residues pruned to eliminate duplicates Z: 18 25.698 1.954 0.536 0.939 1.000 0.941 CB 1.443 18 residues pruned to eliminate duplicates Z: 18 30.242 2.064 0.581 0.930 1.000 0.941 CB 1.572 18 residues pruned to eliminate duplicates Z: 15 30.070 2.110 0.772 0.945 1.000 0.929 CB 1.488 15 residues pruned to eliminate duplicates Z: 17 28.444 1.991 0.865 0.839 0.938 0.625 CA 1.526 17 residues pruned to eliminate duplicates Z: 35 37.010 2.157 0.596 0.855 0.941 0.588 CB 1.446 35 residues pruned to eliminate duplicates Z: 17 24.931 2.026 0.957 0.718 0.812 0.438 CB 1.588 17 residues pruned to eliminate duplicates Z: 17 28.834 1.998 0.714 0.932 1.000 0.812 CB 1.470 17 residues pruned to eliminate duplicates Z: 17 15.349 1.842 0.824 0.467 0.938 0.562 CB 1.259 18 residues pruned to eliminate duplicates Z: 14 29.280 2.391 0.729 0.798 0.923 0.462 CB 1.639 14 residues pruned to eliminate duplicates Z: 61 38.482 2.155 0.874 0.515 0.917 0.533 CB 1.322 61 residues pruned to eliminate duplicates Z: 31 29.193 2.102 0.895 0.611 0.867 0.600 CB 1.390 29 residues pruned to eliminate duplicates Z: 25 36.112 2.429 0.732 0.491 0.958 0.458 CB 1.845 25 residues pruned to eliminate duplicates Z: 10 16.068 2.187 0.802 0.462 1.000 0.778 CB 1.413 10 residues pruned to eliminate duplicates Z: 20 34.871 2.470 0.905 0.477 0.947 0.526 CA 1.836 20 residues pruned to eliminate duplicates Z: 22 17.675 2.041 0.706 0.367 0.857 0.524 CB 1.490 22 residues pruned to eliminate duplicates Z: 112 53.984 2.147 0.635 0.617 0.901 0.649 CB 1.451 112 residues pruned to eliminate duplicates Z: 10 10.798 2.109 0.423 0.601 0.889 0.778 CB 1.225 10 residues pruned to eliminate duplicates Z: 46 33.940 2.121 0.695 0.523 0.889 0.533 CB 1.547 52 residues pruned to eliminate duplicates Z: 16 21.088 2.033 0.829 0.538 0.933 0.667 CB 1.511 16 residues pruned to eliminate duplicates Z: 16 29.303 2.121 0.721 0.804 1.000 0.667 CB 1.590 16 residues pruned to eliminate duplicates Z: 8 5.210 1.691 0.142 0.577 0.857 0.714 CB 1.105 8 residues pruned to eliminate duplicates Z: 107 50.975 2.123 0.775 0.534 0.906 0.519 CB 1.403 107 residues pruned to eliminate duplicates Z: 17 23.536 1.974 0.468 0.936 0.938 0.938 CB 1.509 17 residues pruned to eliminate duplicates Z: 21 19.386 2.154 0.699 0.512 0.900 0.550 CB 1.301 41 residues pruned to eliminate duplicates Z: 17 32.896 2.014 0.856 0.955 1.000 0.875 CB 1.513 17 residues pruned to eliminate duplicates Z: 7 12.310 1.947 0.428 0.709 1.000 0.833 CA 1.496 7 residues pruned to eliminate duplicates Z: 14 29.620 2.037 1.076 0.830 0.923 0.615 CB 1.582 14 residues pruned to eliminate duplicates Z: 19 28.249 1.959 0.650 0.891 1.000 0.833 CB 1.481 19 residues pruned to eliminate duplicates Z: 20 13.995 1.993 0.589 0.469 0.947 0.579 CB 1.104 20 residues pruned to eliminate duplicates Z: 7 4.252 1.803 0.002 0.503 1.000 0.667 CB 0.958 Z: 13 27.685 2.169 0.932 0.807 0.917 0.667 CB 1.591 13 residues pruned to eliminate duplicates Z: 16 30.309 2.046 0.777 0.907 1.000 0.867 CB 1.530 16 residues pruned to eliminate duplicates Z: 37 52.904 2.362 0.675 0.847 1.000 0.722 CB 1.654 37 residues pruned to eliminate duplicates Z: 17 22.186 2.033 0.458 0.923 0.938 0.625 CB 1.403 17 residues pruned to eliminate duplicates Z: 86 57.200 2.226 0.911 0.572 0.929 0.600 CB 1.464 86 residues pruned to eliminate duplicates Z: 25 28.467 2.065 0.992 0.592 0.917 0.708 CB 1.412 26 residues pruned to eliminate duplicates Z: 10 7.636 1.743 1.384 0.548 0.556 0.444 CA 1.052 10 residues pruned to eliminate duplicates Z: 37 53.584 2.365 0.753 0.871 0.944 0.667 CB 1.663 37 residues pruned to eliminate duplicates Z: 12 27.848 2.213 0.918 0.858 0.909 0.636 CB 1.603 12 residues pruned to eliminate duplicates Z: 75 47.409 2.205 0.657 0.569 0.892 0.595 CB 1.583 185 residues pruned to eliminate duplicates Z: 37 48.332 2.369 0.625 0.861 0.944 0.722 CB 1.628 37 residues pruned to eliminate duplicates Z: 17 30.772 2.021 0.736 0.945 1.000 0.750 CB 1.517 17 residues pruned to eliminate duplicates Z: 19 50.724 2.444 0.957 0.917 0.944 0.944 CB 1.868 19 residues pruned to eliminate duplicates Z: 14 20.331 2.285 0.770 0.779 0.692 0.462 CB 1.575 14 residues pruned to eliminate duplicates Z: 23 19.304 2.064 0.594 0.395 0.909 0.636 CB 1.537 23 residues pruned to eliminate duplicates Z: 22 24.460 2.289 0.583 0.421 0.952 0.524 CB 1.679 22 residues pruned to eliminate duplicates Z: 14 16.975 2.068 0.682 0.484 0.923 0.846 CB 1.489 14 residues pruned to eliminate duplicates Z: 13 32.894 2.249 0.795 0.854 1.000 0.750 CB 1.738 13 residues pruned to eliminate duplicates Z: 18 27.607 1.979 0.571 0.917 1.000 0.941 CB 1.520 18 residues pruned to eliminate duplicates Z: 7 4.759 1.898 0.834 0.392 0.667 0.667 CB 0.939 Z: 14 19.346 2.204 0.514 0.515 1.000 0.692 CB 1.584 14 residues pruned to eliminate duplicates Z: 9 7.075 1.663 0.403 0.516 1.000 0.500 CB 1.056 Z: 6 13.702 1.939 0.653 0.824 1.000 0.800 CA 1.445 6 residues pruned to eliminate duplicates Z: 17 27.901 2.010 0.577 0.952 1.000 1.000 CB 1.516 17 residues pruned to eliminate duplicates Z: 38 32.913 2.112 0.722 0.603 0.892 0.703 CB 1.513 38 residues pruned to eliminate duplicates Z: 29 38.254 2.312 0.627 0.799 0.964 0.750 CB 1.534 29 residues pruned to eliminate duplicates Z: 17 10.379 1.951 0.575 0.455 0.812 0.562 CB 1.088 17 residues pruned to eliminate duplicates Z: 17 19.795 2.245 0.725 0.537 0.875 0.688 CB 1.408 7 residues pruned to eliminate duplicates Z: 22 16.401 1.984 0.747 0.434 0.762 0.524 CB 1.451 22 residues pruned to eliminate duplicates Z: 17 29.655 1.941 0.750 0.948 1.000 0.312 CB 1.508 17 residues pruned to eliminate duplicates Z: 11 15.472 2.109 0.590 0.866 0.900 0.800 CB 1.187 Z: 18 17.825 2.088 0.952 0.468 0.765 0.353 CB 1.434 18 residues pruned to eliminate duplicates Z: 21 33.456 2.376 0.732 0.621 0.900 0.600 CB 1.803 21 residues pruned to eliminate duplicates Z: 35 38.444 2.140 0.648 0.857 0.941 0.706 CB 1.464 35 residues pruned to eliminate duplicates Z: 10 10.933 1.752 0.221 0.854 0.889 0.556 CB 1.416 10 residues pruned to eliminate duplicates Z: 34 35.689 2.301 0.876 0.506 0.909 0.667 CB 1.574 34 residues pruned to eliminate duplicates Z: 73 40.879 2.270 0.612 0.443 0.903 0.500 CB 1.547 73 residues pruned to eliminate duplicates Z: 83 52.528 2.162 0.839 0.584 0.939 0.671 CB 1.434 11 residues pruned to eliminate duplicates Z: 20 17.393 1.998 0.376 0.528 1.000 0.789 CB 1.411 20 residues pruned to eliminate duplicates Z: 15 27.165 2.284 0.788 0.847 0.929 0.714 CB 1.421 15 residues pruned to eliminate duplicates Z: 33 32.617 2.333 0.770 0.465 0.875 0.531 CB 1.653 33 residues pruned to eliminate duplicates Z: 51 41.525 2.342 0.565 0.635 0.920 0.640 CB 1.535 51 residues pruned to eliminate duplicates Z: 8 3.141 1.711 0.417 0.377 0.714 0.571 CB 0.781 8 residues pruned to eliminate duplicates Z: 13 4.173 1.633 0.437 0.264 0.583 0.250 CA 1.152 13 residues pruned to eliminate duplicates Z: 16 15.806 1.927 0.267 0.825 1.000 0.667 CB 1.262 16 residues pruned to eliminate duplicates Z: 11 14.506 2.143 0.426 0.543 0.900 0.600 CB 1.598 Z: 36 29.134 2.110 0.450 0.836 0.886 0.771 CB 1.360 36 residues pruned to eliminate duplicates Z: 7 4.738 2.076 0.346 0.256 0.667 0.500 CB 1.374 7 residues pruned to eliminate duplicates Z: 17 29.565 2.050 0.720 0.858 1.000 0.688 CB 1.544 17 residues pruned to eliminate duplicates Z: 15 14.593 1.833 0.265 0.934 1.000 0.929 CB 1.173 Z: 16 28.208 2.054 0.608 0.940 1.000 0.867 CB 1.532 16 residues pruned to eliminate duplicates Z: 8 11.549 1.620 0.714 0.866 1.000 0.714 CB 1.151 8 residues pruned to eliminate duplicates Z: 17 12.110 1.978 0.602 0.605 0.750 0.688 CB 1.153 17 residues pruned to eliminate duplicates Z: 11 20.530 2.345 0.589 0.726 0.800 0.400 CB 1.776 11 residues pruned to eliminate duplicates Z: 19 24.314 2.132 0.440 0.834 0.944 0.722 CB 1.482 19 residues pruned to eliminate duplicates Z: 17 35.299 2.206 1.044 0.800 0.938 0.375 CB 1.606 17 residues pruned to eliminate duplicates Z: 9 3.761 1.614 -0.093 0.522 0.875 0.750 CB 1.016 Z: 21 21.821 2.095 0.939 0.409 0.850 0.500 CB 1.554 21 residues pruned to eliminate duplicates Z: 28 19.906 1.964 0.508 0.601 0.889 0.630 CB 1.322 28 residues pruned to eliminate duplicates Z: 20 27.377 2.054 0.946 0.913 0.789 0.421 CB 1.409 20 residues pruned to eliminate duplicates Z: 31 34.501 2.152 0.764 0.653 0.900 0.600 CB 1.599 31 residues pruned to eliminate duplicates Z: 25 23.954 2.074 0.729 0.569 0.917 0.708 CB 1.391 25 residues pruned to eliminate duplicates Z: 19 46.243 2.484 0.806 0.902 0.944 0.778 CB 1.835 19 residues pruned to eliminate duplicates Z: 37 42.293 2.267 0.578 0.857 0.889 0.667 CB 1.633 37 residues pruned to eliminate duplicates Z: 6 4.813 1.532 0.430 0.479 0.800 0.600 O 1.255 Z: 14 19.834 2.121 0.853 0.711 0.769 0.615 CB 1.503 14 residues pruned to eliminate duplicates Z: 14 16.898 1.959 0.551 0.743 0.923 0.692 CA 1.345 14 residues pruned to eliminate duplicates Z: 44 34.725 2.259 0.714 0.519 0.837 0.605 CB 1.603 41 residues pruned to eliminate duplicates Z: 16 25.034 2.024 0.916 0.786 0.867 0.733 CB 1.495 16 residues pruned to eliminate duplicates Z: 19 22.556 2.404 0.750 0.421 0.722 0.389 CA 1.900 19 residues pruned to eliminate duplicates Z: 9 10.774 1.878 0.592 0.819 1.000 0.500 CB 0.966 9 residues pruned to eliminate duplicates Z: 36 18.083 2.095 0.650 0.274 0.800 0.457 CB 1.428 119 residues pruned to eliminate duplicates Z: 12 13.212 1.933 0.445 0.553 0.909 0.545 CB 1.489 12 residues pruned to eliminate duplicates Z: 16 25.290 1.967 0.825 0.889 0.933 0.733 CB 1.403 16 residues pruned to eliminate duplicates Z: 34 37.903 2.184 0.693 0.847 0.939 0.697 CB 1.411 34 residues pruned to eliminate duplicates Z: 25 26.949 2.082 0.891 0.563 0.958 0.708 CB 1.372 24 residues pruned to eliminate duplicates Z: 12 26.911 2.420 0.447 0.710 1.000 0.818 CB 1.915 12 residues pruned to eliminate duplicates Z: 33 31.528 2.199 0.895 0.524 0.812 0.594 CB 1.607 33 residues pruned to eliminate duplicates Z: 8 15.703 2.031 1.071 0.705 0.857 0.714 CB 1.366 8 residues pruned to eliminate duplicates Z: 17 23.392 1.977 0.444 0.931 1.000 0.750 CA 1.432 17 residues pruned to eliminate duplicates Z: 29 30.290 2.251 0.804 0.554 0.857 0.500 CB 1.560 Z: 12 26.444 2.204 0.750 0.776 1.000 0.727 CB 1.620 12 residues pruned to eliminate duplicates Z: 24 27.682 2.034 0.913 0.588 1.000 0.652 CB 1.363 25 residues pruned to eliminate duplicates Z: 18 28.470 1.986 0.634 0.926 1.000 0.882 CA 1.492 18 residues pruned to eliminate duplicates Z: 9 6.022 1.521 0.507 0.717 0.875 0.750 CB 0.872 Z: 11 9.693 1.910 0.363 0.561 0.800 0.600 CB 1.386 11 residues pruned to eliminate duplicates Z: 9 3.878 1.695 -0.026 0.514 1.000 0.625 N 0.819 Z: 14 34.530 2.329 0.819 0.915 1.000 1.000 CB 1.598 14 residues pruned to eliminate duplicates Z: 23 16.926 1.920 0.563 0.457 0.955 0.500 CB 1.316 23 residues pruned to eliminate duplicates Z: 144 73.643 2.288 0.725 0.570 0.937 0.636 CB 1.556 144 residues pruned to eliminate duplicates Z: 6 7.814 1.913 0.368 0.814 0.800 0.600 CA 1.270 6 residues pruned to eliminate duplicates Z: 15 16.814 2.043 0.943 0.466 0.857 0.643 CB 1.367 15 residues pruned to eliminate duplicates Z: 68 51.248 2.243 0.808 0.581 0.955 0.642 CB 1.496 68 residues pruned to eliminate duplicates Z: 26 27.716 2.221 0.612 0.675 0.840 0.720 CB 1.569 26 residues pruned to eliminate duplicates Z: 17 24.721 2.008 0.430 0.913 1.000 0.938 CB 1.523 17 residues pruned to eliminate duplicates Z: 25 24.478 2.078 0.848 0.570 0.875 0.750 CB 1.389 25 residues pruned to eliminate duplicates Z: 18 25.432 2.346 0.550 0.533 0.882 0.588 CA 1.860 18 residues pruned to eliminate duplicates Z: 14 22.133 1.992 0.777 0.893 0.923 0.769 CB 1.349 14 residues pruned to eliminate duplicates Z: 20 51.062 2.387 0.824 0.916 1.000 0.842 CA 1.901 20 residues pruned to eliminate duplicates Z: 14 26.574 1.996 1.001 0.873 0.923 0.846 CB 1.457 15 residues pruned to eliminate duplicates Z: 109 56.570 2.217 0.871 0.504 0.880 0.472 CB 1.485 109 residues pruned to eliminate duplicates Z: 12 10.820 2.023 0.405 0.343 0.909 0.636 N 1.498 12 residues pruned to eliminate duplicates Z: 13 20.495 2.131 0.743 0.490 1.000 0.750 CB 1.609 Z: 94 52.122 2.268 0.579 0.602 0.935 0.699 CB 1.464 94 residues pruned to eliminate duplicates Z: 37 31.321 2.066 0.662 0.635 0.917 0.750 CB 1.461 37 residues pruned to eliminate duplicates Z: 13 9.118 1.817 0.367 0.448 0.833 0.333 CB 1.341 Z: 11 15.864 2.242 0.433 0.589 0.900 0.800 CB 1.593 12 residues pruned to eliminate duplicates Z: 16 29.419 2.196 0.721 0.799 0.933 0.733 CB 1.657 Z: 15 13.638 1.949 0.623 0.427 0.857 0.714 CB 1.449 15 residues pruned to eliminate duplicates Z: 7 6.003 1.687 0.294 0.733 0.833 0.667 CB 1.093 7 residues pruned to eliminate duplicates Z: 16 14.310 1.844 0.760 0.464 0.933 0.600 CB 1.266 16 residues pruned to eliminate duplicates Z: 15 38.936 2.373 0.831 0.907 1.000 0.571 CB 1.703 15 residues pruned to eliminate duplicates Z: 35 35.394 2.147 0.604 0.847 0.912 0.706 CB 1.436 35 residues pruned to eliminate duplicates Z: 17 24.823 1.977 0.521 0.905 1.000 0.688 CB 1.469 17 residues pruned to eliminate duplicates Z: 20 31.950 2.249 0.688 0.910 0.947 0.737 CB 1.446 20 residues pruned to eliminate duplicates Z: 65 53.417 2.262 0.906 0.605 0.906 0.719 CB 1.547 65 residues pruned to eliminate duplicates Z: 25 21.438 2.037 0.693 0.530 0.917 0.625 CB 1.343 25 residues pruned to eliminate duplicates Z: 65 36.902 2.013 0.700 0.574 0.938 0.531 CB 1.339 16 residues pruned to eliminate duplicates Z: 118 61.262 2.257 0.596 0.593 0.940 0.615 CB 1.531 118 residues pruned to eliminate duplicates Z: 27 23.368 2.062 0.531 0.624 0.923 0.654 CB 1.399 27 residues pruned to eliminate duplicates Z: 48 42.428 2.188 0.888 0.628 0.894 0.596 CB 1.486 48 residues pruned to eliminate duplicates Z: 100 57.871 2.149 0.954 0.577 0.899 0.606 CB 1.430 98 residues pruned to eliminate duplicates Z: 7 4.799 1.688 0.277 0.495 0.833 0.333 N 1.097 Z: 29 42.321 2.310 0.818 0.670 1.000 0.750 CB 1.627 29 residues pruned to eliminate duplicates Z: 8 9.273 2.180 0.488 0.267 0.857 0.429 CA 1.643 8 residues pruned to eliminate duplicates Z: 21 22.159 2.042 0.874 0.436 0.900 0.700 CB 1.537 21 residues pruned to eliminate duplicates Z: 19 25.031 1.988 0.400 0.916 1.000 0.944 CA 1.497 19 residues pruned to eliminate duplicates Z: 33 29.631 2.177 0.742 0.647 0.938 0.531 CB 1.284 14 residues pruned to eliminate duplicates Z: 36 29.377 2.134 0.588 0.622 0.886 0.714 CB 1.475 36 residues pruned to eliminate duplicates Z: 78 52.559 2.189 0.866 0.578 0.935 0.610 CB 1.455 52 residues pruned to eliminate duplicates Z: 19 31.830 1.980 0.809 0.927 1.000 0.889 CA 1.469 19 residues pruned to eliminate duplicates Z: 36 30.911 2.101 0.477 0.841 0.943 0.714 CB 1.332 36 residues pruned to eliminate duplicates Z: 18 27.147 1.991 0.580 0.920 1.000 0.765 CA 1.475 18 residues pruned to eliminate duplicates Z: 84 38.940 2.095 0.565 0.586 0.904 0.542 CB 1.329 84 residues pruned to eliminate duplicates Z: 14 8.968 1.746 0.712 0.341 0.769 0.538 N 1.287 14 residues pruned to eliminate duplicates Z: 20 42.603 2.330 0.923 0.859 0.895 0.789 CA 1.794 20 residues pruned to eliminate duplicates Z: 14 12.366 1.803 0.841 0.576 0.846 0.615 N 1.135 Z: 12 20.058 2.188 0.583 0.533 1.000 0.727 CB 1.692 12 residues pruned to eliminate duplicates Z: 9 5.800 1.893 -0.041 0.604 0.875 0.875 CB 1.169 Z: 18 33.477 1.984 0.907 0.929 1.000 0.824 CB 1.502 18 residues pruned to eliminate duplicates Z: 15 31.090 2.173 0.856 0.852 0.929 0.643 CB 1.640 15 residues pruned to eliminate duplicates Z: 16 9.283 1.895 0.478 0.470 0.733 0.600 CB 1.203 16 residues pruned to eliminate duplicates Z: 7 9.549 1.866 0.399 0.891 0.833 0.833 CA 1.288 7 residues pruned to eliminate duplicates Z: 17 25.715 1.998 0.494 0.906 1.000 0.812 CB 1.532 17 residues pruned to eliminate duplicates Z: 6 6.240 1.729 0.734 0.408 0.800 0.800 CA 1.282 6 residues pruned to eliminate duplicates Z: 29 32.743 2.158 0.994 0.613 0.893 0.571 CB 1.447 29 residues pruned to eliminate duplicates Z: 10 5.262 1.708 0.412 0.352 0.889 0.667 N 0.961 10 residues pruned to eliminate duplicates Z: 7 7.797 1.847 0.631 0.531 0.833 0.833 CB 1.230 7 residues pruned to eliminate duplicates Z: 19 12.442 1.856 0.605 0.455 0.833 0.556 CB 1.237 19 residues pruned to eliminate duplicates Z: 73 58.509 2.218 1.037 0.578 0.931 0.556 CB 1.520 73 residues pruned to eliminate duplicates Z: 15 30.290 2.291 0.857 0.813 1.000 0.429 CB 1.449 15 residues pruned to eliminate duplicates Z: 53 38.173 2.132 0.623 0.663 0.923 0.692 CB 1.425 53 residues pruned to eliminate duplicates Z: 32 32.523 2.302 0.587 0.576 0.871 0.613 CB 1.707 32 residues pruned to eliminate duplicates Z: 7 8.444 2.256 0.626 0.240 0.833 0.667 CB 1.524 7 residues pruned to eliminate duplicates Z: 113 66.225 2.273 0.706 0.624 0.911 0.670 CB 1.576 113 residues pruned to eliminate duplicates Z: 81 55.653 2.201 0.949 0.590 0.913 0.613 CB 1.459 81 residues pruned to eliminate duplicates Z: 6 9.602 1.731 0.659 0.852 1.000 0.800 CA 1.106 Z: 6 3.534 1.977 -0.250 0.732 1.000 0.800 CB 0.866 6 residues pruned to eliminate duplicates Z: 13 23.859 2.276 0.356 0.896 1.000 1.000 CB 1.598 13 residues pruned to eliminate duplicates Z: 61 29.828 2.034 0.735 0.420 0.883 0.550 CB 1.343 61 residues pruned to eliminate duplicates Z: 22 30.692 2.252 0.569 0.868 0.952 0.714 CB 1.455 22 residues pruned to eliminate duplicates Z: 17 33.900 2.175 0.650 0.932 1.000 0.938 CB 1.649 17 residues pruned to eliminate duplicates Z: 17 14.432 1.942 0.921 0.518 0.875 0.625 CB 1.086 17 residues pruned to eliminate duplicates Z: 8 4.560 1.630 -0.089 0.545 1.000 0.571 CB 1.111 Z: 55 46.702 2.261 0.777 0.605 0.889 0.630 CB 1.611 55 residues pruned to eliminate duplicates Z: 25 17.884 2.096 0.771 0.342 0.792 0.458 CB 1.475 25 residues pruned to eliminate duplicates Z: 18 25.347 2.229 0.753 0.846 0.882 0.706 CB 1.325 18 residues pruned to eliminate duplicates Z: 13 21.192 2.155 0.353 0.815 1.000 0.667 CB 1.596 13 residues pruned to eliminate duplicates Z: 7 8.918 1.526 0.366 0.872 1.000 0.833 CB 1.273 Z: 6 6.182 1.966 -0.089 0.596 1.000 0.800 CB 1.407 6 residues pruned to eliminate duplicates Z: 55 40.299 2.173 0.744 0.637 0.907 0.630 CB 1.403 55 residues pruned to eliminate duplicates Z: 11 11.980 1.809 0.661 0.581 0.800 0.700 CA 1.458 11 residues pruned to eliminate duplicates Z: 7 6.455 1.851 0.504 0.533 0.833 0.500 CB 1.100 Z: 23 26.765 2.103 0.802 0.734 0.909 0.636 CB 1.341 23 residues pruned to eliminate duplicates Z: 17 22.271 1.973 0.484 0.898 0.938 0.688 CB 1.451 17 residues pruned to eliminate duplicates Z: 17 22.331 2.186 0.638 0.593 0.875 0.562 CB 1.631 17 residues pruned to eliminate duplicates Z: 18 16.793 1.982 0.420 0.736 0.941 0.647 CB 1.245 18 residues pruned to eliminate duplicates Z: 17 22.572 2.074 0.307 0.917 0.938 0.812 CB 1.567 17 residues pruned to eliminate duplicates Z: 9 21.141 2.077 0.926 0.673 1.000 0.750 CB 1.593 9 residues pruned to eliminate duplicates Z: 15 13.051 1.799 0.210 0.906 1.000 0.857 CB 1.140 15 residues pruned to eliminate duplicates Z: 14 13.345 1.851 0.716 0.475 0.923 0.692 CB 1.295 14 residues pruned to eliminate duplicates Z: 27 48.908 2.405 0.979 0.670 0.962 0.615 CB 1.792 27 residues pruned to eliminate duplicates Z: 7 5.041 1.816 0.168 0.610 1.000 0.333 CB 0.874 7 residues pruned to eliminate duplicates Z: 6 4.100 1.741 0.001 0.683 0.800 0.800 CB 1.112 6 residues pruned to eliminate duplicates Z: 6 6.919 1.881 -0.136 0.723 1.000 0.800 CB 1.557 Z: 15 13.750 1.777 0.267 0.899 1.000 0.857 CB 1.167 15 residues pruned to eliminate duplicates Z: 37 28.036 2.031 0.547 0.603 0.889 0.750 CB 1.517 37 residues pruned to eliminate duplicates Z: 19 14.765 2.088 1.175 0.509 0.778 0.611 CB 0.977 19 residues pruned to eliminate duplicates Z: 6 4.786 1.780 0.975 0.430 0.800 0.400 CB 0.819 Z: 6 6.555 1.848 0.404 0.650 0.800 0.800 CB 1.227 6 residues pruned to eliminate duplicates Z: 18 14.969 1.861 0.538 0.458 0.941 0.588 CA 1.407 16 residues pruned to eliminate duplicates Z: 14 13.579 1.918 0.630 0.440 0.923 0.769 CB 1.388 14 residues pruned to eliminate duplicates Z: 10 24.731 2.278 0.857 0.765 1.000 0.778 CA 1.540 10 residues pruned to eliminate duplicates Z: 34 32.580 2.310 0.588 0.520 0.879 0.636 CB 1.725 34 residues pruned to eliminate duplicates Z: 10 7.775 1.956 0.342 0.408 0.778 0.667 CB 1.399 10 residues pruned to eliminate duplicates Z: 14 25.030 2.264 0.605 0.850 0.846 0.769 CB 1.672 14 residues pruned to eliminate duplicates Z: 15 16.737 1.858 0.409 0.899 1.000 0.714 CB 1.221 15 residues pruned to eliminate duplicates Z: 23 38.651 2.424 0.522 0.854 0.955 0.818 CB 1.727 23 residues pruned to eliminate duplicates Z: 41 48.976 2.333 0.641 0.792 0.975 0.800 CB 1.605 41 residues pruned to eliminate duplicates Z: 17 21.551 1.988 0.318 0.923 1.000 0.812 CB 1.445 17 residues pruned to eliminate duplicates Z: 15 23.890 2.107 0.309 0.930 1.000 0.929 CB 1.619 15 residues pruned to eliminate duplicates Z: 13 21.236 2.119 0.469 0.849 0.917 0.583 CA 1.592 13 residues pruned to eliminate duplicates Z: 40 34.675 2.042 0.945 0.617 0.872 0.641 CB 1.435 40 residues pruned to eliminate duplicates Z: 13 6.216 1.806 0.177 0.295 0.917 0.500 CA 1.158 11 residues pruned to eliminate duplicates Z: 11 13.429 1.790 0.584 0.834 1.000 0.800 CB 1.123 9 residues pruned to eliminate duplicates Z: 13 20.145 2.089 0.921 0.496 0.833 0.583 CB 1.746 13 residues pruned to eliminate duplicates Z: 37 33.010 2.078 0.636 0.859 0.889 0.667 CB 1.339 37 residues pruned to eliminate duplicates Z: 10 7.949 1.981 0.329 0.408 0.889 0.667 CB 1.246 10 residues pruned to eliminate duplicates Z: 21 34.214 2.323 0.821 0.584 0.950 0.600 CA 1.757 21 residues pruned to eliminate duplicates Z: 95 48.454 2.117 0.727 0.564 0.904 0.574 CB 1.420 101 residues pruned to eliminate duplicates 6 1.805 1.555 -0.271 0.327 1.000 0.400 CB 0.861 ? Z: 8 4.076 1.743 0.092 0.313 0.857 0.571 CA 1.161 Z: 6 4.428 1.505 0.721 0.438 0.800 0.800 CB 1.019 Z: 23 35.337 2.401 0.681 0.578 0.955 0.636 CA 1.814 23 residues pruned to eliminate duplicates Z: 18 14.754 1.987 0.614 0.479 0.941 0.412 CB 1.211 18 residues pruned to eliminate duplicates Z: 17 24.364 2.142 0.683 0.606 0.938 0.750 CB 1.629 17 residues pruned to eliminate duplicates Z: 6 4.353 1.337 0.431 0.738 1.000 0.600 CA 0.822 6 residues pruned to eliminate duplicates Z: 16 38.372 2.315 0.833 0.821 1.000 0.467 CA 1.768 16 residues pruned to eliminate duplicates Z: 47 25.577 2.042 0.555 0.514 0.891 0.565 CB 1.313 47 residues pruned to eliminate duplicates Z: 19 14.803 1.803 0.671 0.483 0.944 0.556 CB 1.248 19 residues pruned to eliminate duplicates Z: 9 8.123 1.995 0.440 0.469 1.000 0.375 CB 1.032 9 residues pruned to eliminate duplicates Z: 10 13.111 1.804 0.859 0.608 1.000 0.778 CB 1.176 10 residues pruned to eliminate duplicates Z: 15 13.411 1.813 0.135 0.937 1.000 0.929 CB 1.212 15 residues pruned to eliminate duplicates Z: 14 18.974 2.016 0.275 0.896 1.000 0.769 CA 1.467 14 residues pruned to eliminate duplicates Z: 23 15.522 1.890 0.640 0.478 0.909 0.455 CB 1.201 23 residues pruned to eliminate duplicates Z: 29 32.278 2.248 0.580 0.654 0.929 0.714 CB 1.603 29 residues pruned to eliminate duplicates Z: 7 3.879 1.579 -0.141 0.644 1.000 0.667 CB 1.021 6 residues pruned to eliminate duplicates Z: 14 10.091 1.730 0.400 0.892 1.000 0.615 CB 0.830 14 residues pruned to eliminate duplicates Z: 8 3.358 1.683 0.156 0.473 0.714 0.571 CA 0.939 8 residues pruned to eliminate duplicates Z: 22 14.225 1.908 0.615 0.302 0.857 0.571 CB 1.465 22 residues pruned to eliminate duplicates Z: 7 4.909 1.568 0.866 0.344 0.833 0.500 N 0.974 Z: 6 21.366 2.269 1.049 0.684 1.000 0.200 CB 1.737 6 residues pruned to eliminate duplicates Z: 6 2.177 1.385 0.544 0.433 0.800 0.400 CB 0.610 6 residues pruned to eliminate duplicates Z: 11 4.094 1.826 0.336 0.310 0.700 0.300 CB 0.936 11 residues pruned to eliminate duplicates Z: 18 26.608 2.319 0.715 0.505 0.941 0.647 CA 1.716 18 residues pruned to eliminate duplicates Z: 16 7.526 1.818 0.378 0.470 0.800 0.467 CB 1.000 9 residues pruned to eliminate duplicates Z: 26 24.656 1.980 0.870 0.614 0.920 0.760 CB 1.300 26 residues pruned to eliminate duplicates Z: 6 13.354 2.197 0.971 0.504 0.800 0.600 CB 1.716 6 residues pruned to eliminate duplicates Z: 27 41.698 2.445 0.720 0.699 0.962 0.615 CB 1.687 27 residues pruned to eliminate duplicates Z: 16 29.377 1.990 0.859 0.792 1.000 0.467 CB 1.587 16 residues pruned to eliminate duplicates Z: 14 22.369 1.898 0.844 0.886 0.923 0.308 CB 1.386 14 residues pruned to eliminate duplicates Z: 53 48.721 2.379 0.620 0.620 0.904 0.731 CB 1.733 53 residues pruned to eliminate duplicates Z: 28 14.691 1.784 0.493 0.512 0.889 0.593 CB 1.179 28 residues pruned to eliminate duplicates Z: 105 51.073 2.141 0.712 0.543 0.923 0.558 CB 1.419 106 residues pruned to eliminate duplicates Z: 16 27.213 2.109 0.539 0.937 0.933 0.867 CB 1.614 16 residues pruned to eliminate duplicates Z: 14 13.005 1.828 0.189 0.917 1.000 1.000 CB 1.172 14 residues pruned to eliminate duplicates Z: 8 4.512 1.700 -0.067 0.517 0.857 0.429 N 1.234 Z: 13 14.412 1.934 0.602 0.892 0.917 0.750 CB 1.052 13 residues pruned to eliminate duplicates Z: 10 4.452 1.634 0.185 0.410 0.889 0.444 CB 0.947 8 residues pruned to eliminate duplicates Z: 11 6.938 1.867 0.305 0.715 0.600 0.400 CB 1.236 11 residues pruned to eliminate duplicates Z: 12 13.544 2.233 0.220 0.509 1.000 0.727 CB 1.486 12 residues pruned to eliminate duplicates Z: 18 14.652 1.966 0.353 0.719 0.882 0.647 CB 1.242 18 residues pruned to eliminate duplicates Z: 6 2.474 1.464 0.881 0.302 0.600 0.400 CA 0.836 Z: 6 2.437 1.736 -0.356 0.400 1.000 0.800 CB 1.083 Z: 16 27.879 2.326 0.694 0.675 0.867 0.600 CB 1.793 16 residues pruned to eliminate duplicates Z: 12 13.342 1.989 0.492 0.545 1.000 0.545 CB 1.297 11 residues pruned to eliminate duplicates Z: 14 36.294 2.295 1.186 0.915 0.923 0.769 CB 1.536 14 residues pruned to eliminate duplicates Z: 13 20.714 1.981 0.989 0.603 1.000 0.833 CB 1.375 15 residues pruned to eliminate duplicates 8 1.971 1.894 -0.355 0.503 1.000 0.571 CB 0.608 ? Z: 16 16.927 1.758 0.559 0.919 1.000 0.600 CB 1.123 15 residues pruned to eliminate duplicates Z: 7 12.210 1.795 0.693 0.766 1.000 0.500 CA 1.296 7 residues pruned to eliminate duplicates Z: 18 22.653 1.944 0.328 0.918 1.000 0.765 CA 1.501 18 residues pruned to eliminate duplicates Z: 7 2.661 1.554 0.287 0.282 0.667 0.333 C 1.042 Z: 33 31.042 2.188 0.635 0.651 0.938 0.531 CB 1.422 33 residues pruned to eliminate duplicates Z: 25 17.583 1.884 0.910 0.537 0.833 0.583 CB 1.154 25 residues pruned to eliminate duplicates Z: 13 16.464 1.931 0.879 0.593 0.750 0.583 CB 1.598 13 residues pruned to eliminate duplicates Z: 12 17.755 2.120 0.708 0.572 0.909 0.636 CB 1.517 12 residues pruned to eliminate duplicates Z: 10 4.566 1.409 0.349 0.478 0.889 0.556 CB 0.922 Z: 9 7.739 1.900 -0.084 0.616 1.000 0.750 CB 1.409 7 residues pruned to eliminate duplicates Z: 22 42.682 2.235 0.996 0.876 0.952 0.667 CB 1.593 22 residues pruned to eliminate duplicates Z: 25 34.403 2.441 0.801 0.460 0.917 0.500 CB 1.815 25 residues pruned to eliminate duplicates Z: 12 4.635 1.624 0.146 0.333 0.727 0.273 CB 1.239 Z: 8 3.357 1.717 -0.029 0.445 0.857 0.286 CB 0.939 Z: 6 4.431 1.697 0.806 0.298 1.000 0.400 CB 0.810 6 residues pruned to eliminate duplicates Z: 8 8.340 1.670 0.646 0.573 1.000 0.857 CB 1.068 Z: 20 21.425 2.034 0.647 0.523 1.000 0.684 CB 1.434 20 residues pruned to eliminate duplicates 6 1.374 1.239 0.222 0.331 0.800 0.400 N 0.610 ? Z: 30 34.271 2.377 0.738 0.499 0.897 0.517 CB 1.721 30 residues pruned to eliminate duplicates Z: 19 21.946 2.105 0.578 0.530 1.000 0.778 CB 1.513 19 residues pruned to eliminate duplicates Z: 42 33.125 2.071 1.039 0.521 0.902 0.537 CB 1.329 42 residues pruned to eliminate duplicates Z: 23 29.362 2.212 0.878 0.525 0.909 0.591 CB 1.616 23 residues pruned to eliminate duplicates Z: 13 19.557 1.933 1.080 0.909 0.917 0.667 CB 1.087 14 residues pruned to eliminate duplicates Z: 14 31.777 2.173 0.945 0.861 1.000 0.846 CB 1.532 14 residues pruned to eliminate duplicates Z: 16 26.304 2.086 0.687 0.882 1.000 0.800 CB 1.396 16 residues pruned to eliminate duplicates Z: 64 45.839 2.310 0.664 0.568 0.921 0.587 CB 1.528 64 residues pruned to eliminate duplicates Z: 16 28.988 2.140 0.739 0.843 1.000 0.600 CB 1.498 16 residues pruned to eliminate duplicates Z: 6 2.366 1.524 -0.017 0.332 1.000 0.400 CB 0.849 Z: 9 15.360 1.987 0.554 0.654 1.000 1.000 CB 1.524 9 residues pruned to eliminate duplicates Z: 6 2.798 1.538 -0.276 0.472 1.000 0.600 O 1.156 Z: 37 32.031 2.059 0.776 0.635 0.917 0.639 CB 1.402 37 residues pruned to eliminate duplicates Z: 49 33.378 2.125 0.895 0.570 0.875 0.583 CB 1.278 49 residues pruned to eliminate duplicates Z: 14 21.246 2.144 0.795 0.483 1.000 0.846 CB 1.558 14 residues pruned to eliminate duplicates Z: 16 12.104 1.891 0.467 0.580 0.933 0.667 CB 1.118 16 residues pruned to eliminate duplicates Z: 6 3.655 1.733 -0.130 0.551 0.800 0.600 O 1.290 6 residues pruned to eliminate duplicates Z: 16 15.012 1.946 0.667 0.439 1.000 0.800 CB 1.273 15 residues pruned to eliminate duplicates Z: 19 20.194 2.249 0.608 0.320 0.889 0.444 CB 1.806 19 residues pruned to eliminate duplicates Z: 57 46.532 2.285 0.766 0.551 0.946 0.571 CB 1.548 57 residues pruned to eliminate duplicates Z: 16 11.853 1.766 0.024 0.926 1.000 0.867 CB 1.187 15 residues pruned to eliminate duplicates Z: 19 11.394 1.749 0.346 0.495 0.944 0.611 CB 1.214 19 residues pruned to eliminate duplicates Z: 7 4.323 1.980 0.299 0.233 0.667 0.500 CB 1.404 7 residues pruned to eliminate duplicates Z: 35 37.472 2.149 0.676 0.845 0.941 0.765 CB 1.410 35 residues pruned to eliminate duplicates Z: 38 31.013 1.999 0.763 0.582 0.892 0.730 CB 1.499 38 residues pruned to eliminate duplicates Z: 25 22.430 2.095 0.699 0.602 0.875 0.542 CB 1.335 25 residues pruned to eliminate duplicates Z: 6 5.680 1.946 -0.079 0.673 1.000 0.600 CB 1.208 Z: 7 10.581 1.786 1.115 0.550 0.833 0.833 CA 1.307 7 residues pruned to eliminate duplicates Z: 7 3.795 1.771 0.383 0.408 0.833 0.500 CB 0.836 Z: 110 61.417 2.227 0.684 0.582 0.917 0.587 CB 1.580 110 residues pruned to eliminate duplicates Z: 21 15.171 1.996 0.501 0.434 0.900 0.550 N 1.347 35 residues pruned to eliminate duplicates Z: 11 11.233 1.684 0.752 0.674 0.800 0.500 CB 1.281 11 residues pruned to eliminate duplicates Z: 37 50.492 2.340 0.767 0.853 0.944 0.722 CB 1.593 37 residues pruned to eliminate duplicates Z: 7 13.191 2.326 0.761 0.466 1.000 0.333 CB 1.361 7 residues pruned to eliminate duplicates Z: 22 15.615 1.973 0.390 0.588 0.857 0.619 CB 1.332 22 residues pruned to eliminate duplicates Z: 12 14.390 1.915 0.798 0.466 0.909 0.636 CB 1.435 12 residues pruned to eliminate duplicates Z: 7 6.182 1.707 0.769 0.779 0.833 0.333 CB 0.784 Z: 70 46.101 2.146 0.762 0.557 0.942 0.580 CB 1.474 70 residues pruned to eliminate duplicates Z: 14 11.202 1.835 0.048 0.911 1.000 0.846 CB 1.146 14 residues pruned to eliminate duplicates Z: 32 35.617 2.120 1.052 0.524 0.935 0.613 CB 1.535 32 residues pruned to eliminate duplicates Z: 14 8.945 1.623 0.477 0.581 0.846 0.692 CB 1.131 14 residues pruned to eliminate duplicates Z: 69 41.571 2.120 0.689 0.590 0.912 0.676 CB 1.417 69 residues pruned to eliminate duplicates Z: 10 10.517 1.975 0.821 0.391 0.889 0.444 CB 1.231 10 residues pruned to eliminate duplicates Z: 6 4.800 1.726 0.210 0.488 1.000 0.600 CA 1.040 Z: 16 17.958 2.163 0.201 0.889 0.867 0.733 CB 1.482 16 residues pruned to eliminate duplicates Z: 14 14.240 1.907 0.610 0.506 1.000 0.692 CB 1.279 14 residues pruned to eliminate duplicates Z: 19 19.556 2.132 0.333 0.842 0.833 0.722 CB 1.451 19 residues pruned to eliminate duplicates Z: 28 25.629 2.072 0.810 0.659 0.889 0.556 CB 1.277 28 residues pruned to eliminate duplicates Z: 7 8.228 1.785 0.719 0.550 0.833 0.667 N 1.251 Z: 6 4.052 1.392 0.317 0.797 0.800 0.600 CB 0.952 5 residues pruned to eliminate duplicates Z: 29 34.099 2.399 0.712 0.462 0.929 0.500 CB 1.756 36 residues pruned to eliminate duplicates Z: 18 13.677 1.892 0.306 0.463 0.882 0.588 CA 1.579 18 residues pruned to eliminate duplicates Z: 55 46.649 2.275 0.800 0.564 0.926 0.556 CB 1.573 55 residues pruned to eliminate duplicates Z: 27 26.334 2.295 0.451 0.495 0.962 0.615 CB 1.621 27 residues pruned to eliminate duplicates Z: 17 19.570 2.192 0.630 0.637 0.812 0.750 CB 1.481 17 residues pruned to eliminate duplicates Z: 23 25.002 2.197 0.692 0.567 0.909 0.636 CB 1.478 23 residues pruned to eliminate duplicates Z: 12 6.790 1.830 0.476 0.831 1.000 0.909 CB 0.569 17 residues pruned to eliminate duplicates Z: 39 34.454 2.191 0.785 0.571 0.921 0.526 CB 1.449 39 residues pruned to eliminate duplicates Z: 30 33.305 1.961 0.880 0.713 0.931 0.621 CB 1.485 30 residues pruned to eliminate duplicates Z: 11 12.845 2.024 0.477 0.604 1.000 0.600 CB 1.231 11 residues pruned to eliminate duplicates Z: 17 23.346 1.973 0.586 0.920 1.000 0.375 CB 1.313 17 residues pruned to eliminate duplicates Z: 32 27.970 2.074 0.861 0.525 0.968 0.516 CB 1.313 32 residues pruned to eliminate duplicates Z: 13 16.047 1.957 0.878 0.446 0.917 0.583 CB 1.454 14 residues pruned to eliminate duplicates Z: 8 11.700 1.896 0.886 0.534 1.000 0.571 N 1.196 8 residues pruned to eliminate duplicates Z: 13 17.818 2.040 0.630 0.769 0.833 0.417 CB 1.463 13 residues pruned to eliminate duplicates Z: 16 17.006 2.179 0.535 0.475 0.800 0.667 CB 1.683 16 residues pruned to eliminate duplicates Z: 7 3.710 2.006 0.081 0.411 0.667 0.333 CB 1.150 7 residues pruned to eliminate duplicates Z: 31 28.065 2.238 0.957 0.440 0.800 0.533 CB 1.556 31 residues pruned to eliminate duplicates Z: 9 7.445 1.834 -0.014 0.557 1.000 0.500 CB 1.377 10 residues pruned to eliminate duplicates Z: 10 17.293 2.043 0.660 0.682 1.000 0.444 CB 1.438 10 residues pruned to eliminate duplicates Z: 19 32.132 2.006 0.698 0.934 1.000 0.944 CB 1.551 19 residues pruned to eliminate duplicates Z: 9 5.678 1.837 0.528 0.225 0.875 0.375 CB 1.127 9 residues pruned to eliminate duplicates Z: 6 5.137 1.711 0.216 0.800 1.000 0.800 CA 0.849 Z: 14 16.279 1.958 0.503 0.632 1.000 0.769 CB 1.355 14 residues pruned to eliminate duplicates Z: 18 24.457 1.925 0.592 0.862 0.941 0.588 CB 1.510 17 residues pruned to eliminate duplicates Z: 16 20.901 2.072 0.131 0.902 1.000 0.867 CB 1.642 16 residues pruned to eliminate duplicates Z: 27 22.537 1.993 0.750 0.531 0.923 0.654 CB 1.331 27 residues pruned to eliminate duplicates Z: 10 3.554 1.698 0.177 0.385 0.556 0.556 C 1.205 10 residues pruned to eliminate duplicates Z: 41 30.918 2.179 0.585 0.533 0.850 0.600 CB 1.613 41 residues pruned to eliminate duplicates Z: 17 37.547 2.297 0.912 0.663 1.000 0.562 CB 1.837 17 residues pruned to eliminate duplicates Z: 17 26.697 2.011 0.600 0.947 1.000 0.312 CB 1.434 17 residues pruned to eliminate duplicates Z: 31 46.321 2.453 0.907 0.593 0.967 0.700 CB 1.710 31 residues pruned to eliminate duplicates Z: 9 12.789 1.875 0.356 0.835 1.000 0.875 CB 1.333 9 residues pruned to eliminate duplicates Z: 36 35.890 2.127 0.845 0.655 0.914 0.686 CB 1.463 36 residues pruned to eliminate duplicates 6 1.054 1.013 0.205 0.291 0.800 0.400 CB 0.610 ? Z: 11 13.697 1.961 0.599 0.501 1.000 0.600 CB 1.380 11 residues pruned to eliminate duplicates Z: 15 17.815 2.123 0.529 0.413 0.929 0.571 CA 1.730 15 residues pruned to eliminate duplicates Z: 17 22.950 1.997 0.737 0.881 0.938 0.875 CB 1.278 17 residues pruned to eliminate duplicates Z: 8 4.338 1.696 0.363 0.830 1.000 0.857 CB 0.533 8 residues pruned to eliminate duplicates Z: 70 43.288 2.248 0.622 0.544 0.928 0.594 CB 1.475 70 residues pruned to eliminate duplicates Z: 8 6.003 1.816 -0.055 0.836 0.857 0.571 CB 1.154 8 residues pruned to eliminate duplicates Z: 6 2.757 1.606 0.342 0.367 0.600 0.400 CB 1.100 Z: 17 20.802 2.022 0.878 0.583 0.875 0.750 CB 1.446 17 residues pruned to eliminate duplicates Z: 17 16.333 1.893 0.323 0.820 1.000 0.750 CB 1.235 17 residues pruned to eliminate duplicates Z: 50 43.288 2.185 0.784 0.599 0.959 0.694 CB 1.505 50 residues pruned to eliminate duplicates Z: 11 11.692 1.897 0.371 0.551 0.900 0.600 CB 1.503 8 residues pruned to eliminate duplicates Z: 6 10.994 1.938 0.479 0.860 1.000 0.800 CA 1.261 6 residues pruned to eliminate duplicates Z: 6 4.533 1.612 0.778 0.458 0.800 0.400 CB 0.923 Z: 20 27.258 2.340 0.685 0.433 0.947 0.474 CA 1.794 20 residues pruned to eliminate duplicates Z: 37 24.250 2.056 0.503 0.525 0.917 0.639 CB 1.392 37 residues pruned to eliminate duplicates Z: 47 52.113 2.195 0.974 0.688 0.957 0.652 CB 1.561 47 residues pruned to eliminate duplicates Z: 38 27.835 1.964 0.826 0.556 0.946 0.541 CB 1.277 38 residues pruned to eliminate duplicates Z: 37 47.352 2.346 0.593 0.844 0.944 0.722 CB 1.664 37 residues pruned to eliminate duplicates Z: 7 3.566 1.721 0.236 0.340 0.667 0.500 CA 1.222 Z: 14 18.454 1.840 0.722 0.933 1.000 0.615 CB 1.127 15 residues pruned to eliminate duplicates Z: 26 43.894 2.292 1.010 0.651 0.960 0.720 CB 1.725 26 residues pruned to eliminate duplicates Z: 76 53.599 2.227 0.862 0.571 0.933 0.533 CB 1.494 76 residues pruned to eliminate duplicates Z: 11 8.854 2.010 0.657 0.457 0.800 0.500 CB 1.098 11 residues pruned to eliminate duplicates Z: 30 31.670 2.346 0.626 0.507 0.897 0.483 CB 1.706 30 residues pruned to eliminate duplicates Z: 20 42.357 2.254 0.999 0.935 1.000 0.737 CB 1.503 20 residues pruned to eliminate duplicates Z: 20 29.460 2.285 0.631 0.597 1.000 0.684 CB 1.654 164 residues pruned to eliminate duplicates Z: 17 18.206 1.735 0.618 0.907 1.000 0.750 CB 1.152 16 residues pruned to eliminate duplicates Z: 98 51.465 2.117 0.746 0.562 0.938 0.588 CB 1.419 Z: 18 34.525 2.306 0.716 0.817 0.941 0.882 CB 1.708 18 residues pruned to eliminate duplicates Z: 10 5.495 1.568 0.733 0.329 0.667 0.444 CB 1.220 10 residues pruned to eliminate duplicates Z: 11 3.432 1.807 -0.032 0.325 0.700 0.400 CB 1.074 11 residues pruned to eliminate duplicates Z: 21 28.339 2.298 0.662 0.674 0.900 0.850 CB 1.570 21 residues pruned to eliminate duplicates Z: 16 11.654 1.732 0.114 0.908 1.000 0.933 CB 1.108 16 residues pruned to eliminate duplicates Z: 6 8.466 1.884 0.654 0.619 1.000 0.800 CB 1.086 9 residues pruned to eliminate duplicates Z: 21 21.462 2.339 0.674 0.298 0.950 0.450 CB 1.617 20 residues pruned to eliminate duplicates Z: 27 31.180 2.136 0.870 0.568 0.885 0.615 CB 1.620 38 residues pruned to eliminate duplicates Z: 15 32.908 2.076 0.917 0.942 1.000 0.786 CB 1.533 22 residues pruned to eliminate duplicates Z: 16 22.327 1.916 0.677 0.937 1.000 0.867 CB 1.248 16 residues pruned to eliminate duplicates Z: 13 17.622 1.961 0.912 0.510 0.917 0.667 CA 1.466 13 residues pruned to eliminate duplicates Z: 11 13.327 2.108 1.139 0.338 0.800 0.200 CB 1.394 11 residues pruned to eliminate duplicates Z: 23 23.134 2.242 0.439 0.612 0.864 0.682 CA 1.591 23 residues pruned to eliminate duplicates Z: 15 19.861 1.872 0.584 0.803 0.929 0.643 CB 1.480 15 residues pruned to eliminate duplicates Z: 15 14.513 1.838 0.375 0.913 0.929 0.714 CB 1.170 15 residues pruned to eliminate duplicates 6 1.850 1.472 0.069 0.300 0.800 0.600 CB 0.822 ? Z: 38 41.312 2.269 0.827 0.580 0.919 0.568 CB 1.651 38 residues pruned to eliminate duplicates Z: 6 3.162 1.697 -0.098 0.443 1.000 0.600 CB 0.980 6 residues pruned to eliminate duplicates Z: 16 31.000 2.293 0.710 0.773 1.000 0.533 CA 1.603 16 residues pruned to eliminate duplicates Z: 12 23.494 2.182 0.771 0.612 1.000 0.909 CB 1.648 15 residues pruned to eliminate duplicates Z: 100 53.736 2.133 0.813 0.587 0.899 0.616 CB 1.429 98 residues pruned to eliminate duplicates Z: 11 3.285 1.584 0.395 0.263 0.700 0.400 CB 0.880 Z: 20 27.459 2.070 0.940 0.859 0.842 0.579 CB 1.371 20 residues pruned to eliminate duplicates Z: 10 2.683 1.367 0.432 0.347 0.778 0.222 CB 0.694 Z: 7 12.095 1.929 0.743 0.715 1.000 0.833 CB 1.209 7 residues pruned to eliminate duplicates Z: 77 45.491 2.152 0.815 0.549 0.921 0.513 CB 1.382 77 residues pruned to eliminate duplicates Z: 18 32.841 2.251 0.842 0.719 1.000 0.882 CB 1.575 18 residues pruned to eliminate duplicates Z: 12 13.841 2.062 0.382 0.862 0.909 0.818 CB 1.183 12 residues pruned to eliminate duplicates Z: 17 29.370 2.018 0.816 0.909 1.000 0.625 CB 1.423 17 residues pruned to eliminate duplicates Z: 27 31.072 2.335 0.529 0.646 0.885 0.615 CB 1.684 27 residues pruned to eliminate duplicates 6 1.792 1.521 0.600 0.296 0.600 0.400 CB 0.690 ? Z: 15 21.559 2.109 0.897 0.856 0.786 0.571 CB 1.352 15 residues pruned to eliminate duplicates Z: 8 11.907 1.909 0.595 0.654 0.857 0.857 CA 1.494 Z: 9 18.527 2.176 0.317 0.851 1.000 0.750 CB 1.692 9 residues pruned to eliminate duplicates Z: 15 11.461 1.804 0.110 0.920 1.000 0.714 CB 1.077 15 residues pruned to eliminate duplicates Z: 51 42.047 2.197 0.827 0.560 0.920 0.520 CB 1.518 51 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 9 4.024 1.725 -0.233 0.490 0.875 0.500 N 1.242 8 residues pruned to eliminate duplicates Z: 16 28.925 2.152 0.798 0.815 0.933 0.733 CB 1.573 16 residues pruned to eliminate duplicates Z: 67 56.105 2.252 0.903 0.587 0.970 0.591 CB 1.528 67 residues pruned to eliminate duplicates Z: 65 56.473 2.263 0.937 0.595 0.938 0.625 CB 1.569 65 residues pruned to eliminate duplicates Z: 73 56.660 2.240 0.939 0.587 0.944 0.583 CB 1.498 73 residues pruned to eliminate duplicates Z: 66 44.772 2.206 0.776 0.554 0.923 0.600 CB 1.457 66 residues pruned to eliminate duplicates Z: 68 54.326 2.251 0.963 0.589 0.925 0.582 CB 1.490 68 residues pruned to eliminate duplicates Z: 84 51.059 2.168 0.908 0.531 0.916 0.542 CB 1.435 84 residues pruned to eliminate duplicates Z: 74 51.600 2.221 0.899 0.565 0.904 0.616 CB 1.487 74 residues pruned to eliminate duplicates Z: 67 55.620 2.229 0.929 0.589 0.970 0.621 CB 1.509 67 residues pruned to eliminate duplicates Z: 61 45.494 2.172 1.004 0.502 0.883 0.550 CB 1.524 61 residues pruned to eliminate duplicates Z: 69 50.498 2.231 0.902 0.567 0.897 0.471 CB 1.508 69 residues pruned to eliminate duplicates Z: 67 52.522 2.240 0.870 0.559 0.939 0.545 CB 1.552 67 residues pruned to eliminate duplicates Z: 73 56.650 2.224 0.994 0.577 0.917 0.542 CB 1.524 73 residues pruned to eliminate duplicates Z: 67 54.586 2.253 0.916 0.563 0.970 0.561 CB 1.511 67 residues pruned to eliminate duplicates Z: 65 52.479 2.254 0.836 0.562 0.969 0.578 CB 1.541 65 residues pruned to eliminate duplicates Z: 59 41.684 2.160 0.892 0.522 0.897 0.534 CB 1.461 59 residues pruned to eliminate duplicates Z: 68 54.067 2.246 0.846 0.572 0.970 0.597 CB 1.531 68 residues pruned to eliminate duplicates Z: 90 50.896 2.137 0.857 0.550 0.888 0.618 CB 1.459 90 residues pruned to eliminate duplicates Z: 42 33.325 2.114 0.950 0.485 0.902 0.463 CB 1.419 42 residues pruned to eliminate duplicates Z: 68 52.022 2.241 0.882 0.586 0.925 0.627 CB 1.500 68 residues pruned to eliminate duplicates Z: 73 48.977 2.203 0.908 0.547 0.903 0.556 CB 1.454 73 residues pruned to eliminate duplicates Z: 68 54.471 2.253 0.907 0.597 0.925 0.567 CB 1.527 68 residues pruned to eliminate duplicates Z: 80 53.025 2.215 0.879 0.544 0.911 0.544 CB 1.508 80 residues pruned to eliminate duplicates Z: 67 50.761 2.214 0.811 0.590 0.955 0.591 CB 1.497 67 residues pruned to eliminate duplicates Z: 68 49.648 2.213 0.822 0.593 0.955 0.567 CB 1.441 68 residues pruned to eliminate duplicates Z: 74 50.821 2.191 0.922 0.572 0.904 0.562 CB 1.457 74 residues pruned to eliminate duplicates Z: 68 46.682 2.215 0.719 0.591 0.940 0.627 CB 1.460 68 residues pruned to eliminate duplicates Z: 64 59.311 2.260 0.958 0.611 0.968 0.556 CB 1.570 64 residues pruned to eliminate duplicates Z: 66 51.386 2.250 0.836 0.591 0.923 0.677 CB 1.532 66 residues pruned to eliminate duplicates Z: 65 57.041 2.266 0.937 0.575 0.984 0.641 CB 1.534 65 residues pruned to eliminate duplicates Z: 19 22.318 2.302 0.744 0.455 0.889 0.722 CB 1.543 18 residues pruned to eliminate duplicates Z: 6 4.354 1.748 1.010 0.281 0.800 0.600 CA 0.886 6 residues pruned to eliminate duplicates Z: 16 20.150 2.268 0.783 0.489 0.867 0.733 CB 1.501 17 residues pruned to eliminate duplicates Z: 6 7.019 1.584 0.868 0.404 1.000 0.800 N 1.174 6 residues pruned to eliminate duplicates Z: 17 21.238 2.239 0.719 0.507 0.875 0.625 CA 1.565 17 residues pruned to eliminate duplicates Z: 57 36.949 2.192 0.632 0.565 0.929 0.679 CB 1.395 57 residues pruned to eliminate duplicates Z: 18 18.863 2.233 0.561 0.536 0.941 0.647 CB 1.346 18 residues pruned to eliminate duplicates Z: 20 21.191 2.206 0.759 0.497 0.895 0.579 CB 1.404 20 residues pruned to eliminate duplicates Z: 19 13.957 2.089 0.621 0.416 0.833 0.556 CB 1.273 19 residues pruned to eliminate duplicates Z: 18 22.242 2.208 0.778 0.554 0.882 0.529 CB 1.477 18 residues pruned to eliminate duplicates Z: 17 23.094 2.257 0.785 0.502 0.938 0.438 CA 1.525 17 residues pruned to eliminate duplicates Z: 9 9.154 2.115 0.597 0.393 0.750 0.625 CB 1.431 9 residues pruned to eliminate duplicates Z: 9 7.022 1.997 0.762 0.393 0.625 0.500 CB 1.264 9 residues pruned to eliminate duplicates Z: 16 16.899 1.956 0.799 0.393 0.933 0.667 CA 1.489 16 residues pruned to eliminate duplicates Z: 14 19.921 2.079 0.869 0.427 1.000 0.692 CB 1.533 14 residues pruned to eliminate duplicates Z: 15 19.776 2.034 0.807 0.483 1.000 0.786 CB 1.463 15 residues pruned to eliminate duplicates Z: 15 17.791 2.025 0.807 0.450 1.000 0.643 CB 1.368 15 residues pruned to eliminate duplicates Z: 15 20.592 2.029 0.885 0.424 1.000 0.643 CB 1.557 12 residues pruned to eliminate duplicates Z: 6 7.086 1.893 0.567 0.438 1.000 0.800 CA 1.139 6 residues pruned to eliminate duplicates Z: 19 18.486 1.881 0.861 0.490 0.889 0.500 CB 1.414 15 residues pruned to eliminate duplicates Z: 8 9.111 1.866 0.465 0.494 0.857 0.429 CA 1.478 8 residues pruned to eliminate duplicates Z: 13 23.175 2.151 1.006 0.454 1.000 0.750 CB 1.625 13 residues pruned to eliminate duplicates Z: 10 14.118 2.025 0.349 0.783 1.000 0.778 CB 1.342 11 residues pruned to eliminate duplicates Z: 11 14.032 1.857 0.491 0.809 1.000 0.600 CB 1.224 10 residues pruned to eliminate duplicates Z: 11 12.627 1.802 0.652 0.730 0.900 0.600 CA 1.211 12 residues pruned to eliminate duplicates Z: 10 11.022 1.843 0.566 0.707 0.889 0.667 CB 1.186 10 residues pruned to eliminate duplicates Z: 17 19.825 2.149 0.655 0.422 1.000 0.625 CA 1.511 17 residues pruned to eliminate duplicates Z: 23 20.758 2.004 0.638 0.440 0.955 0.636 CB 1.504 23 residues pruned to eliminate duplicates Z: 20 23.045 2.048 0.710 0.519 1.000 0.737 CB 1.481 20 residues pruned to eliminate duplicates Z: 17 22.492 2.182 0.721 0.448 1.000 0.750 CA 1.580 17 residues pruned to eliminate duplicates Z: 18 21.998 2.149 0.831 0.402 0.941 0.706 CB 1.596 18 residues pruned to eliminate duplicates Z: 22 21.079 2.075 0.791 0.421 0.905 0.619 CB 1.485 22 residues pruned to eliminate duplicates Z: 17 21.378 2.123 0.819 0.430 0.938 0.688 CB 1.587 17 residues pruned to eliminate duplicates Z: 19 23.127 2.114 0.963 0.450 0.944 0.722 CB 1.464 19 residues pruned to eliminate duplicates Z: 21 23.718 1.979 0.927 0.497 0.950 0.650 CB 1.470 21 residues pruned to eliminate duplicates Z: 13 8.368 1.782 0.644 0.376 0.750 0.500 CB 1.256 14 residues pruned to eliminate duplicates Z: 17 12.939 1.740 0.131 0.908 1.000 1.000 CB 1.167 17 residues pruned to eliminate duplicates Z: 17 16.083 1.764 0.446 0.884 0.938 0.938 CB 1.215 17 residues pruned to eliminate duplicates Z: 16 14.380 1.820 0.163 0.929 1.000 0.933 CB 1.227 16 residues pruned to eliminate duplicates Z: 16 14.653 1.771 0.389 0.852 0.933 0.867 CB 1.219 16 residues pruned to eliminate duplicates Z: 16 16.119 1.823 0.374 0.935 1.000 0.867 CB 1.158 16 residues pruned to eliminate duplicates Z: 16 15.849 1.752 0.581 0.911 0.933 0.667 CB 1.122 16 residues pruned to eliminate duplicates Z: 20 13.146 1.617 0.492 0.746 1.000 0.526 CB 1.003 20 residues pruned to eliminate duplicates Z: 16 17.997 1.771 0.772 0.877 0.933 0.733 CB 1.152 16 residues pruned to eliminate duplicates Z: 14 17.306 1.837 0.725 0.923 1.000 0.385 CB 1.064 14 residues pruned to eliminate duplicates Z: 17 15.845 1.711 0.617 0.900 0.938 0.562 CB 1.091 17 residues pruned to eliminate duplicates Z: 17 18.704 1.741 0.720 0.883 1.000 0.812 CB 1.129 17 residues pruned to eliminate duplicates Z: 15 18.697 1.796 0.759 0.938 1.000 0.286 CB 1.100 15 residues pruned to eliminate duplicates Z: 18 15.482 1.680 0.603 0.829 1.000 0.647 CB 1.050 17 residues pruned to eliminate duplicates Z: 16 19.505 1.753 0.761 0.922 1.000 0.600 CB 1.147 16 residues pruned to eliminate duplicates Z: 6 2.599 1.379 0.496 0.329 0.800 0.600 N 0.850 Z: 6 8.306 1.764 1.441 0.337 0.800 0.600 CB 1.289 6 residues pruned to eliminate duplicates Z: 14 17.181 2.185 0.578 0.396 1.000 0.769 CB 1.543 14 residues pruned to eliminate duplicates Z: 15 19.200 2.055 0.725 0.441 1.000 0.714 CB 1.538 12 residues pruned to eliminate duplicates Z: 6 3.838 1.968 0.472 0.347 0.600 0.400 CB 1.167 6 residues pruned to eliminate duplicates Z: 14 17.116 2.156 0.878 0.358 0.923 0.615 CB 1.480 14 residues pruned to eliminate duplicates Z: 14 14.982 2.079 0.760 0.471 0.846 0.462 CB 1.382 14 residues pruned to eliminate duplicates Z: 11 16.493 2.306 0.923 0.492 0.800 0.600 CB 1.482 11 residues pruned to eliminate duplicates Z: 22 25.580 2.302 0.631 0.444 0.905 0.429 CA 1.741 33 residues pruned to eliminate duplicates Z: 45 36.298 2.287 0.886 0.429 0.886 0.545 CB 1.540 60 residues pruned to eliminate duplicates Z: 36 29.923 2.284 0.728 0.400 0.886 0.457 CB 1.608 36 residues pruned to eliminate duplicates Z: 34 31.796 2.342 0.647 0.449 0.909 0.515 CB 1.664 25 residues pruned to eliminate duplicates Z: 31 29.164 2.342 0.693 0.403 0.867 0.400 CB 1.717 31 residues pruned to eliminate duplicates Z: 32 34.872 2.365 0.894 0.423 0.871 0.484 CB 1.740 32 residues pruned to eliminate duplicates Z: 32 32.918 2.398 0.888 0.398 0.839 0.419 CB 1.734 32 residues pruned to eliminate duplicates Z: 25 34.286 2.467 0.785 0.448 0.917 0.542 CB 1.828 27 residues pruned to eliminate duplicates Z: 35 39.118 2.366 0.824 0.501 0.912 0.500 CB 1.703 34 residues pruned to eliminate duplicates Z: 23 27.038 2.437 0.733 0.425 0.818 0.591 CB 1.803 23 residues pruned to eliminate duplicates Z: 20 25.426 2.405 0.575 0.421 0.947 0.579 CA 1.765 20 residues pruned to eliminate duplicates Z: 41 35.775 2.319 0.714 0.446 0.925 0.500 CB 1.626 41 residues pruned to eliminate duplicates Z: 36 28.711 2.268 0.606 0.443 0.886 0.429 CB 1.595 36 residues pruned to eliminate duplicates Z: 27 30.228 2.377 0.589 0.406 0.962 0.423 CB 1.801 27 residues pruned to eliminate duplicates Z: 22 28.660 2.338 0.813 0.448 0.905 0.571 CB 1.721 22 residues pruned to eliminate duplicates Z: 26 40.187 2.431 0.895 0.484 0.960 0.440 CB 1.846 26 residues pruned to eliminate duplicates Z: 32 31.524 2.327 0.857 0.373 0.839 0.387 CB 1.789 32 residues pruned to eliminate duplicates Z: 19 41.455 2.506 1.081 0.525 0.944 0.556 CA 1.936 19 residues pruned to eliminate duplicates Z: 32 33.822 2.375 0.879 0.415 0.871 0.419 CB 1.709 32 residues pruned to eliminate duplicates Z: 36 37.031 2.369 0.799 0.464 0.886 0.371 CB 1.721 36 residues pruned to eliminate duplicates Z: 33 20.152 2.283 0.680 0.295 0.719 0.344 CB 1.625 33 residues pruned to eliminate duplicates Z: 17 11.563 1.921 0.874 0.294 0.750 0.438 CB 1.348 17 residues pruned to eliminate duplicates Z: 27 30.399 2.387 0.689 0.439 0.885 0.423 CB 1.780 27 residues pruned to eliminate duplicates Z: 58 37.372 2.145 0.681 0.587 0.860 0.526 CB 1.468 58 residues pruned to eliminate duplicates Z: 13 14.171 2.006 0.658 0.449 0.833 0.417 CA 1.555 113 residues pruned to eliminate duplicates Z: 18 12.050 1.957 0.776 0.312 0.706 0.412 N 1.468 Z: 52 29.114 2.073 0.732 0.464 0.843 0.510 CB 1.397 70 residues pruned to eliminate duplicates Z: 16 14.533 2.044 0.769 0.455 0.800 0.533 CB 1.359 16 residues pruned to eliminate duplicates Z: 30 15.995 1.868 0.859 0.346 0.828 0.414 CB 1.222 30 residues pruned to eliminate duplicates Z: 16 9.849 1.828 0.512 0.379 0.733 0.333 CA 1.427 Z: 100 46.950 2.161 0.691 0.576 0.879 0.576 CB 1.366 116 residues pruned to eliminate duplicates Z: 14 8.983 1.884 0.974 0.405 0.769 0.615 CB 0.962 Z: 105 38.995 2.107 0.545 0.534 0.827 0.548 CB 1.374 132 residues pruned to eliminate duplicates 6 1.536 1.760 0.289 0.293 0.600 0.400 CB 0.636 ? Z: 10 15.061 2.025 0.963 0.675 1.000 0.889 CB 1.074 Z: 18 16.474 2.051 0.915 0.479 0.824 0.529 CB 1.262 28 residues pruned to eliminate duplicates Z: 20 15.485 2.016 0.584 0.460 0.842 0.684 CB 1.376 20 residues pruned to eliminate duplicates Z: 41 37.466 2.176 0.725 0.644 0.925 0.675 CB 1.491 41 residues pruned to eliminate duplicates Z: 39 32.528 2.161 0.851 0.627 0.868 0.605 CB 1.348 39 residues pruned to eliminate duplicates Z: 71 34.548 2.111 0.534 0.558 0.886 0.586 CB 1.361 71 residues pruned to eliminate duplicates Z: 43 35.585 2.121 0.767 0.629 0.905 0.643 CB 1.433 43 residues pruned to eliminate duplicates Z: 40 40.236 2.189 0.812 0.665 0.949 0.641 CB 1.470 40 residues pruned to eliminate duplicates Z: 8 4.746 2.052 0.275 0.134 0.714 0.429 CB 1.513 8 residues pruned to eliminate duplicates Z: 29 37.220 2.264 0.755 0.634 0.964 0.679 CB 1.619 29 residues pruned to eliminate duplicates Z: 41 36.426 2.160 0.801 0.645 0.900 0.550 CB 1.437 41 residues pruned to eliminate duplicates Z: 65 44.149 2.221 0.734 0.536 0.906 0.500 CB 1.527 65 residues pruned to eliminate duplicates Z: 24 40.321 2.265 0.797 0.771 1.000 0.652 CB 1.625 24 residues pruned to eliminate duplicates Z: 58 38.369 2.084 0.640 0.641 0.930 0.596 CB 1.401 58 residues pruned to eliminate duplicates Z: 26 31.856 2.168 0.848 0.700 0.920 0.640 CB 1.440 26 residues pruned to eliminate duplicates Z: 21 39.592 2.211 0.980 0.856 0.950 0.650 CB 1.571 21 residues pruned to eliminate duplicates Z: 73 40.348 2.170 0.564 0.645 0.889 0.611 CB 1.376 73 residues pruned to eliminate duplicates Z: 42 34.780 2.135 0.724 0.615 0.927 0.683 CB 1.429 42 residues pruned to eliminate duplicates Z: 23 40.698 2.267 0.794 0.819 1.000 0.591 CB 1.618 23 residues pruned to eliminate duplicates Z: 24 40.338 2.232 0.880 0.803 0.957 0.696 CB 1.608 24 residues pruned to eliminate duplicates Z: 42 35.719 2.141 0.775 0.606 0.927 0.707 CB 1.432 42 residues pruned to eliminate duplicates Z: 23 42.167 2.249 0.956 0.805 1.000 0.727 CB 1.566 23 residues pruned to eliminate duplicates Z: 22 40.205 2.244 0.982 0.845 0.952 0.667 CB 1.539 22 residues pruned to eliminate duplicates Z: 21 41.187 2.263 0.894 0.838 1.000 0.650 CB 1.607 21 residues pruned to eliminate duplicates Z: 50 32.108 2.121 0.547 0.599 0.918 0.633 CB 1.384 50 residues pruned to eliminate duplicates Z: 76 42.708 2.139 0.662 0.634 0.907 0.667 CB 1.349 76 residues pruned to eliminate duplicates Z: 21 42.089 2.271 0.898 0.879 1.000 0.800 CB 1.584 21 residues pruned to eliminate duplicates Z: 68 41.869 2.195 0.686 0.594 0.896 0.687 CB 1.411 68 residues pruned to eliminate duplicates Z: 11 23.933 2.332 0.739 0.788 0.900 0.900 CB 1.610 11 residues pruned to eliminate duplicates Z: 40 31.671 2.146 0.554 0.645 0.949 0.744 CB 1.401 40 residues pruned to eliminate duplicates Z: 85 43.341 2.172 0.599 0.561 0.893 0.655 CB 1.437 85 residues pruned to eliminate duplicates Z: 87 46.296 2.152 0.615 0.577 0.930 0.558 CB 1.434 87 residues pruned to eliminate duplicates Z: 43 36.358 2.159 0.501 0.692 0.952 0.619 CB 1.524 43 residues pruned to eliminate duplicates Z: 82 43.102 2.167 0.569 0.591 0.914 0.556 CB 1.413 82 residues pruned to eliminate duplicates Z: 69 48.979 2.192 0.680 0.690 0.956 0.676 CB 1.417 69 residues pruned to eliminate duplicates Z: 38 39.087 2.175 0.647 0.747 0.973 0.649 CB 1.478 38 residues pruned to eliminate duplicates Z: 51 34.127 2.129 0.543 0.663 0.900 0.620 CB 1.403 51 residues pruned to eliminate duplicates Z: 16 14.376 2.089 0.280 0.763 0.800 0.733 CB 1.374 16 residues pruned to eliminate duplicates Z: 43 38.450 2.185 0.539 0.666 0.976 0.714 CB 1.550 43 residues pruned to eliminate duplicates Z: 44 27.320 2.049 0.449 0.623 0.977 0.651 CB 1.279 44 residues pruned to eliminate duplicates Z: 17 15.857 2.001 0.333 0.761 1.000 0.625 CB 1.179 17 residues pruned to eliminate duplicates Z: 53 32.061 2.093 0.613 0.577 0.904 0.635 CB 1.354 53 residues pruned to eliminate duplicates Z: 86 42.103 2.138 0.616 0.596 0.882 0.624 CB 1.366 86 residues pruned to eliminate duplicates Z: 52 37.415 2.147 0.637 0.651 0.922 0.588 CB 1.406 52 residues pruned to eliminate duplicates Z: 58 37.401 2.143 0.569 0.583 0.947 0.561 CB 1.437 58 residues pruned to eliminate duplicates Z: 108 46.591 2.107 0.551 0.599 0.907 0.626 CB 1.384 114 residues pruned to eliminate duplicates Z: 124 57.774 2.163 0.657 0.617 0.911 0.667 CB 1.429 124 residues pruned to eliminate duplicates Z: 104 53.200 2.177 0.607 0.647 0.913 0.689 CB 1.432 104 residues pruned to eliminate duplicates Z: 65 39.732 2.119 0.606 0.629 0.922 0.625 CB 1.402 65 residues pruned to eliminate duplicates Z: 81 40.671 2.131 0.524 0.594 0.913 0.637 CB 1.403 81 residues pruned to eliminate duplicates Z: 57 32.324 2.119 0.611 0.549 0.875 0.589 CB 1.378 57 residues pruned to eliminate duplicates Z: 82 48.778 2.156 0.753 0.629 0.901 0.605 CB 1.409 82 residues pruned to eliminate duplicates Z: 50 31.360 2.093 0.667 0.549 0.918 0.592 CB 1.333 50 residues pruned to eliminate duplicates Z: 29 21.466 2.104 0.555 0.558 0.857 0.500 CB 1.367 29 residues pruned to eliminate duplicates Z: 66 42.140 2.140 0.714 0.589 0.923 0.600 CB 1.417 66 residues pruned to eliminate duplicates Z: 125 58.390 2.158 0.699 0.610 0.911 0.653 CB 1.414 125 residues pruned to eliminate duplicates Z: 103 50.502 2.158 0.697 0.618 0.892 0.657 CB 1.369 103 residues pruned to eliminate duplicates Z: 52 38.440 2.153 0.792 0.652 0.882 0.627 CB 1.373 52 residues pruned to eliminate duplicates Z: 73 46.245 2.155 0.647 0.665 0.903 0.694 CB 1.460 73 residues pruned to eliminate duplicates Z: 84 48.340 2.169 0.688 0.581 0.904 0.602 CB 1.484 84 residues pruned to eliminate duplicates Z: 70 38.308 2.136 0.625 0.537 0.884 0.594 CB 1.450 70 residues pruned to eliminate duplicates Z: 69 40.899 2.122 0.660 0.627 0.897 0.632 CB 1.393 69 residues pruned to eliminate duplicates Z: 88 46.269 2.137 0.665 0.624 0.920 0.621 CB 1.349 88 residues pruned to eliminate duplicates Z: 46 32.976 2.181 0.756 0.560 0.889 0.733 CB 1.362 46 residues pruned to eliminate duplicates Z: 52 36.338 2.149 0.618 0.611 0.961 0.588 CB 1.371 52 residues pruned to eliminate duplicates Z: 60 38.827 2.135 0.674 0.622 0.915 0.661 CB 1.377 60 residues pruned to eliminate duplicates Z: 105 56.451 2.181 0.647 0.648 0.923 0.644 CB 1.454 105 residues pruned to eliminate duplicates Z: 37 24.049 2.135 0.651 0.523 0.861 0.639 CB 1.291 37 residues pruned to eliminate duplicates Z: 53 31.422 2.125 0.667 0.598 0.846 0.481 CB 1.323 53 residues pruned to eliminate duplicates Z: 42 31.302 2.190 0.696 0.584 0.854 0.634 CB 1.423 42 residues pruned to eliminate duplicates Z: 69 44.243 2.151 0.713 0.641 0.926 0.574 CB 1.378 69 residues pruned to eliminate duplicates Z: 70 39.714 2.108 0.738 0.585 0.899 0.623 CB 1.338 70 residues pruned to eliminate duplicates Z: 45 33.983 2.147 0.706 0.630 0.909 0.636 CB 1.361 45 residues pruned to eliminate duplicates Z: 25 26.087 2.191 0.686 0.644 0.917 0.583 CB 1.374 25 residues pruned to eliminate duplicates Z: 58 42.206 2.174 0.726 0.657 0.930 0.632 CB 1.384 58 residues pruned to eliminate duplicates Z: 87 43.817 2.128 0.636 0.600 0.895 0.651 CB 1.377 87 residues pruned to eliminate duplicates Z: 57 40.468 2.186 0.725 0.638 0.911 0.661 CB 1.384 57 residues pruned to eliminate duplicates Z: 80 49.940 2.160 0.792 0.654 0.911 0.620 CB 1.381 80 residues pruned to eliminate duplicates Z: 79 37.110 2.123 0.556 0.578 0.859 0.551 CB 1.374 79 residues pruned to eliminate duplicates Z: 64 41.648 2.151 0.695 0.616 0.905 0.524 CB 1.425 64 residues pruned to eliminate duplicates Z: 60 37.179 2.119 0.668 0.588 0.898 0.576 CB 1.401 60 residues pruned to eliminate duplicates Z: 37 32.548 2.159 0.738 0.590 0.889 0.639 CB 1.492 37 residues pruned to eliminate duplicates Z: 38 32.960 2.152 0.768 0.614 0.892 0.676 CB 1.433 38 residues pruned to eliminate duplicates Z: 41 24.839 2.095 0.732 0.440 0.850 0.550 CB 1.355 41 residues pruned to eliminate duplicates Z: 12 15.058 2.071 0.863 0.498 0.727 0.636 CB 1.622 12 residues pruned to eliminate duplicates Z: 39 31.546 2.141 0.718 0.610 0.868 0.684 CB 1.444 39 residues pruned to eliminate duplicates Z: 38 30.325 2.156 0.592 0.628 0.865 0.676 CB 1.488 38 residues pruned to eliminate duplicates Z: 40 31.628 2.134 0.720 0.595 0.897 0.692 CB 1.404 40 residues pruned to eliminate duplicates Z: 36 31.979 2.201 0.567 0.648 0.914 0.743 CB 1.494 36 residues pruned to eliminate duplicates Z: 37 33.067 2.152 0.681 0.637 0.917 0.694 CB 1.462 37 residues pruned to eliminate duplicates Z: 52 31.845 2.071 0.676 0.584 0.843 0.588 CB 1.406 52 residues pruned to eliminate duplicates Z: 58 45.179 2.234 0.632 0.595 0.912 0.702 CB 1.644 58 residues pruned to eliminate duplicates Z: 40 31.861 2.161 0.729 0.586 0.897 0.692 CB 1.400 40 residues pruned to eliminate duplicates Z: 40 32.615 2.137 0.775 0.606 0.897 0.744 CB 1.387 40 residues pruned to eliminate duplicates Z: 39 33.062 2.157 0.734 0.636 0.895 0.763 CB 1.411 39 residues pruned to eliminate duplicates Z: 37 31.055 2.143 0.625 0.623 0.889 0.694 CB 1.490 37 residues pruned to eliminate duplicates Z: 38 33.436 2.150 0.743 0.613 0.892 0.730 CB 1.478 38 residues pruned to eliminate duplicates Z: 23 24.917 2.086 0.607 0.736 0.909 0.727 CA 1.410 23 residues pruned to eliminate duplicates Z: 22 29.955 2.130 0.778 0.740 0.905 0.810 CB 1.539 22 residues pruned to eliminate duplicates Z: 38 34.315 2.189 0.772 0.617 0.892 0.676 CB 1.460 38 residues pruned to eliminate duplicates Z: 58 38.307 2.081 0.747 0.663 0.842 0.632 CB 1.425 58 residues pruned to eliminate duplicates Z: 38 31.748 2.134 0.851 0.617 0.865 0.676 CB 1.368 38 residues pruned to eliminate duplicates Z: 37 31.683 2.102 0.803 0.635 0.861 0.722 CB 1.426 37 residues pruned to eliminate duplicates Z: 24 27.757 2.058 0.763 0.712 0.957 0.696 CB 1.376 24 residues pruned to eliminate duplicates Z: 23 27.483 2.123 0.701 0.692 0.909 0.682 CB 1.497 23 residues pruned to eliminate duplicates Z: 24 26.249 2.048 0.727 0.698 0.913 0.739 CB 1.414 24 residues pruned to eliminate duplicates Z: 26 28.766 1.965 0.852 0.691 0.960 0.760 CB 1.382 26 residues pruned to eliminate duplicates Z: 23 26.689 2.051 0.886 0.687 0.864 0.591 CB 1.435 23 residues pruned to eliminate duplicates Z: 24 31.026 2.124 0.984 0.711 0.870 0.783 CB 1.458 24 residues pruned to eliminate duplicates Z: 32 24.405 2.045 0.717 0.581 0.903 0.581 CB 1.279 38 residues pruned to eliminate duplicates Z: 39 35.956 2.096 1.113 0.638 0.921 0.553 CB 1.257 39 residues pruned to eliminate duplicates Z: 25 27.667 2.050 0.905 0.689 0.917 0.417 CB 1.327 25 residues pruned to eliminate duplicates Z: 52 47.094 2.246 0.781 0.603 0.922 0.490 CB 1.622 52 residues pruned to eliminate duplicates Z: 32 27.105 2.339 0.464 0.478 0.839 0.645 CB 1.733 32 residues pruned to eliminate duplicates Z: 23 28.669 2.334 0.619 0.571 0.864 0.545 CA 1.748 23 residues pruned to eliminate duplicates Z: 43 40.782 2.137 0.858 0.666 0.929 0.548 CB 1.464 43 residues pruned to eliminate duplicates Z: 32 31.027 2.336 0.647 0.459 0.935 0.645 CA 1.615 32 residues pruned to eliminate duplicates Z: 67 52.321 2.263 0.927 0.546 0.894 0.561 CB 1.580 67 residues pruned to eliminate duplicates Z: 20 34.460 2.425 0.720 0.553 0.947 0.579 CB 1.901 20 residues pruned to eliminate duplicates Z: 28 27.550 2.276 0.716 0.484 0.852 0.444 CB 1.620 28 residues pruned to eliminate duplicates Z: 22 23.674 2.356 0.559 0.457 0.810 0.476 CA 1.815 22 residues pruned to eliminate duplicates Z: 28 39.837 2.473 0.808 0.447 0.926 0.593 CA 1.955 28 residues pruned to eliminate duplicates Z: 55 40.733 2.117 0.877 0.504 0.889 0.500 CB 1.564 55 residues pruned to eliminate duplicates Z: 39 30.461 2.294 0.674 0.452 0.816 0.526 CB 1.656 39 residues pruned to eliminate duplicates Z: 21 25.572 2.382 0.683 0.519 0.850 0.450 CA 1.647 21 residues pruned to eliminate duplicates Z: 24 22.932 2.330 0.546 0.470 0.826 0.435 CB 1.657 24 residues pruned to eliminate duplicates Z: 29 34.586 2.375 0.795 0.472 0.857 0.607 CB 1.841 29 residues pruned to eliminate duplicates Z: 20 31.790 2.421 0.670 0.618 0.895 0.632 CB 1.804 20 residues pruned to eliminate duplicates Z: 21 28.612 2.330 0.669 0.511 0.850 0.650 CB 1.915 21 residues pruned to eliminate duplicates Z: 34 34.062 2.297 0.663 0.508 0.879 0.606 CB 1.753 60 residues pruned to eliminate duplicates Z: 31 39.994 2.399 0.675 0.493 0.967 0.533 CA 1.892 31 residues pruned to eliminate duplicates Z: 28 36.924 2.409 0.881 0.483 0.889 0.556 CB 1.794 28 residues pruned to eliminate duplicates Z: 29 33.439 2.420 0.698 0.442 0.893 0.571 CB 1.828 29 residues pruned to eliminate duplicates Z: 29 34.208 2.403 0.749 0.466 0.893 0.679 CB 1.784 29 residues pruned to eliminate duplicates Z: 29 33.399 2.411 0.740 0.445 0.893 0.536 CA 1.784 29 residues pruned to eliminate duplicates Z: 29 44.682 2.488 0.884 0.518 0.964 0.714 CB 1.836 29 residues pruned to eliminate duplicates Z: 28 35.481 2.453 0.763 0.473 0.889 0.519 CB 1.827 28 residues pruned to eliminate duplicates Z: 31 30.553 2.312 0.657 0.462 0.867 0.533 CA 1.748 31 residues pruned to eliminate duplicates Z: 29 31.271 2.278 0.676 0.494 0.929 0.643 CA 1.677 29 residues pruned to eliminate duplicates Z: 33 25.684 2.056 0.799 0.437 0.875 0.531 CB 1.497 33 residues pruned to eliminate duplicates Z: 31 38.014 2.307 0.683 0.552 0.967 0.633 CB 1.758 31 residues pruned to eliminate duplicates Z: 35 36.728 2.337 0.688 0.500 0.941 0.647 CB 1.696 35 residues pruned to eliminate duplicates Z: 29 37.738 2.427 0.636 0.505 0.929 0.643 CB 1.925 29 residues pruned to eliminate duplicates Z: 53 49.537 2.378 0.663 0.579 0.904 0.635 CA 1.781 53 residues pruned to eliminate duplicates Z: 47 35.550 2.243 0.705 0.500 0.870 0.630 CB 1.577 47 residues pruned to eliminate duplicates Z: 37 30.719 2.223 0.591 0.531 0.861 0.639 CB 1.631 37 residues pruned to eliminate duplicates Z: 38 39.998 2.300 0.768 0.568 0.919 0.649 CB 1.647 37 residues pruned to eliminate duplicates Z: 7 2.699 1.631 0.171 0.283 0.667 0.333 CA 1.105 7 residues pruned to eliminate duplicates Z: 32 33.867 2.367 0.508 0.608 0.903 0.677 CB 1.703 32 residues pruned to eliminate duplicates Z: 27 29.217 2.272 0.683 0.648 0.846 0.692 CB 1.543 27 residues pruned to eliminate duplicates Z: 37 33.415 2.275 0.578 0.579 0.889 0.722 CB 1.617 37 residues pruned to eliminate duplicates Z: 36 30.720 2.255 0.557 0.602 0.829 0.686 CB 1.620 36 residues pruned to eliminate duplicates Z: 29 39.374 2.390 0.627 0.652 0.929 0.643 CB 1.789 29 residues pruned to eliminate duplicates Z: 53 40.267 2.302 0.569 0.553 0.904 0.558 CB 1.625 53 residues pruned to eliminate duplicates Z: 35 34.481 2.335 0.496 0.619 0.941 0.706 CB 1.607 35 residues pruned to eliminate duplicates Z: 24 37.214 2.396 0.628 0.687 0.957 0.696 CB 1.752 24 residues pruned to eliminate duplicates Z: 67 45.781 2.228 0.724 0.593 0.894 0.591 CB 1.501 67 residues pruned to eliminate duplicates Z: 35 38.651 2.320 0.665 0.636 0.912 0.706 CB 1.657 35 residues pruned to eliminate duplicates Z: 35 35.406 2.340 0.603 0.627 0.882 0.735 CB 1.628 35 residues pruned to eliminate duplicates Z: 23 41.374 2.459 0.733 0.692 1.000 0.773 CB 1.737 23 residues pruned to eliminate duplicates Z: 37 34.873 2.262 0.660 0.562 0.917 0.694 CB 1.590 37 residues pruned to eliminate duplicates Z: 33 34.766 2.283 0.622 0.596 0.875 0.656 CB 1.731 33 residues pruned to eliminate duplicates Z: 37 36.869 2.292 0.619 0.615 0.917 0.667 CB 1.620 37 residues pruned to eliminate duplicates Z: 34 34.650 2.296 0.581 0.572 0.909 0.667 CB 1.706 34 residues pruned to eliminate duplicates Z: 31 37.216 2.291 0.678 0.608 0.933 0.733 CB 1.710 31 residues pruned to eliminate duplicates Z: 6 5.282 1.580 0.205 0.399 1.000 0.800 CA 1.381 6 residues pruned to eliminate duplicates Z: 17 17.237 2.142 0.643 0.404 0.875 0.438 CB 1.549 17 residues pruned to eliminate duplicates Z: 32 38.320 2.376 0.724 0.586 0.903 0.710 CB 1.712 32 residues pruned to eliminate duplicates Z: 29 36.558 2.354 0.730 0.606 0.893 0.643 CB 1.718 29 residues pruned to eliminate duplicates Z: 38 30.162 2.268 0.500 0.556 0.892 0.703 CB 1.548 38 residues pruned to eliminate duplicates Z: 36 34.361 2.293 0.643 0.592 0.914 0.629 CB 1.543 36 residues pruned to eliminate duplicates Z: 17 27.245 2.059 0.551 0.934 0.938 0.750 CB 1.586 17 residues pruned to eliminate duplicates Z: 19 25.691 1.919 0.532 0.887 1.000 0.833 CB 1.485 19 residues pruned to eliminate duplicates Z: 18 28.276 1.991 0.524 0.920 1.000 0.824 CB 1.591 18 residues pruned to eliminate duplicates Z: 16 29.325 2.091 0.578 0.923 1.000 0.800 CB 1.613 16 residues pruned to eliminate duplicates Z: 16 29.854 2.111 0.570 0.947 1.000 0.867 CB 1.607 16 residues pruned to eliminate duplicates Z: 17 28.048 2.054 0.487 0.934 1.000 0.875 CB 1.602 18 residues pruned to eliminate duplicates Z: 16 26.486 2.103 0.495 0.937 0.933 0.933 CB 1.622 16 residues pruned to eliminate duplicates Z: 16 27.765 2.126 0.551 0.913 0.933 0.867 CB 1.648 16 residues pruned to eliminate duplicates Z: 17 29.047 2.049 0.701 0.919 0.938 0.875 CB 1.566 17 residues pruned to eliminate duplicates Z: 18 26.435 1.981 0.611 0.863 0.941 0.647 CB 1.566 18 residues pruned to eliminate duplicates Z: 18 28.421 2.000 0.530 0.934 1.000 0.647 CB 1.571 17 residues pruned to eliminate duplicates Z: 17 27.184 2.055 0.449 0.922 1.000 0.750 CB 1.605 17 residues pruned to eliminate duplicates Z: 20 23.367 1.903 0.571 0.818 0.947 0.684 CB 1.436 20 residues pruned to eliminate duplicates Z: 16 27.016 2.130 0.554 0.925 0.933 0.933 CB 1.585 16 residues pruned to eliminate duplicates Z: 16 28.395 2.072 0.641 0.881 1.000 0.800 CB 1.561 16 residues pruned to eliminate duplicates Z: 30 25.850 1.977 0.568 0.649 0.966 0.724 CB 1.396 30 residues pruned to eliminate duplicates Z: 17 21.631 1.980 0.524 0.827 0.875 0.750 CB 1.544 17 residues pruned to eliminate duplicates Z: 30 26.620 1.972 0.591 0.648 0.966 0.655 CB 1.421 30 residues pruned to eliminate duplicates Z: 12 16.211 2.063 0.834 0.498 1.000 0.727 CB 1.295 12 residues pruned to eliminate duplicates Z: 14 13.244 1.868 0.715 0.467 1.000 0.692 CB 1.185 14 residues pruned to eliminate duplicates Z: 23 12.208 1.708 0.558 0.448 0.864 0.500 CB 1.194 29 residues pruned to eliminate duplicates Z: 13 14.712 1.994 0.765 0.424 1.000 0.583 CB 1.306 13 residues pruned to eliminate duplicates Z: 14 13.365 1.952 0.646 0.499 0.923 0.692 CB 1.251 14 residues pruned to eliminate duplicates Z: 14 12.308 1.900 0.406 0.460 1.000 0.615 CB 1.332 14 residues pruned to eliminate duplicates Z: 13 15.112 1.978 0.729 0.483 1.000 0.667 CB 1.298 13 residues pruned to eliminate duplicates Z: 14 11.368 1.860 0.698 0.422 0.923 0.615 CB 1.173 14 residues pruned to eliminate duplicates Z: 7 4.942 1.665 0.781 0.117 0.833 0.500 CB 1.323 Z: 6 5.524 1.695 0.709 0.263 0.800 0.400 CB 1.397 6 residues pruned to eliminate duplicates Z: 24 27.759 2.362 0.801 0.352 0.870 0.435 CA 1.837 24 residues pruned to eliminate duplicates Z: 20 31.206 2.426 0.901 0.458 0.842 0.526 CB 1.924 20 residues pruned to eliminate duplicates Z: 22 26.995 2.307 0.818 0.455 0.857 0.524 CB 1.715 22 residues pruned to eliminate duplicates Z: 25 34.593 2.482 0.807 0.464 0.875 0.417 CB 1.867 25 residues pruned to eliminate duplicates Z: 19 27.127 2.422 1.020 0.432 0.833 0.500 CB 1.682 19 residues pruned to eliminate duplicates Z: 29 31.908 2.422 0.954 0.437 0.786 0.500 CB 1.731 29 residues pruned to eliminate duplicates Z: 20 29.450 2.465 0.756 0.387 0.895 0.368 CA 1.968 20 residues pruned to eliminate duplicates Z: 30 31.073 2.344 0.840 0.459 0.828 0.552 CB 1.685 30 residues pruned to eliminate duplicates Z: 29 21.501 2.245 0.823 0.322 0.750 0.250 CB 1.611 29 residues pruned to eliminate duplicates Z: 44 33.385 2.263 0.792 0.433 0.884 0.512 CB 1.523 44 residues pruned to eliminate duplicates Z: 25 30.335 2.458 0.785 0.457 0.833 0.458 CB 1.770 25 residues pruned to eliminate duplicates Z: 23 15.030 2.191 0.616 0.356 0.818 0.364 CB 1.292 23 residues pruned to eliminate duplicates Z: 10 12.571 2.191 0.988 0.262 0.889 0.222 CB 1.419 10 residues pruned to eliminate duplicates Z: 7 8.599 2.383 0.751 0.295 0.667 0.167 CA 1.588 7 residues pruned to eliminate duplicates Z: 6 11.665 2.259 0.841 0.406 1.000 0.200 CA 1.385 6 residues pruned to eliminate duplicates Z: 27 31.411 2.333 0.803 0.457 0.885 0.500 CA 1.730 27 residues pruned to eliminate duplicates Z: 10 11.207 2.169 0.806 0.391 0.778 0.444 CB 1.376 10 residues pruned to eliminate duplicates Z: 6 4.694 1.808 0.383 0.289 1.000 0.600 CB 1.064 6 residues pruned to eliminate duplicates Z: 114 63.966 2.252 0.641 0.626 0.912 0.619 CB 1.587 114 residues pruned to eliminate duplicates Z: 30 40.798 2.357 0.848 0.606 0.966 0.586 CB 1.629 30 residues pruned to eliminate duplicates Z: 8 9.429 2.103 0.670 0.210 1.000 0.286 CB 1.430 8 residues pruned to eliminate duplicates Z: 29 45.667 2.434 0.749 0.642 1.000 0.679 CB 1.775 29 residues pruned to eliminate duplicates Z: 30 41.822 2.348 0.696 0.641 1.000 0.759 CB 1.709 30 residues pruned to eliminate duplicates Z: 31 36.961 2.359 0.606 0.573 0.933 0.633 CB 1.779 31 residues pruned to eliminate duplicates Z: 31 35.412 2.310 0.747 0.582 0.900 0.600 CB 1.646 31 residues pruned to eliminate duplicates Z: 16 17.373 2.139 0.498 0.545 0.867 0.600 CB 1.546 16 residues pruned to eliminate duplicates Z: 30 37.312 2.355 0.682 0.615 0.931 0.517 CB 1.684 30 residues pruned to eliminate duplicates Z: 29 43.350 2.411 0.768 0.630 0.964 0.679 CB 1.764 29 residues pruned to eliminate duplicates Z: 41 39.021 2.261 0.780 0.616 0.950 0.700 CB 1.445 42 residues pruned to eliminate duplicates Z: 20 49.173 2.431 0.899 0.896 1.000 0.789 CA 1.751 20 residues pruned to eliminate duplicates Z: 24 46.581 2.374 0.785 0.720 1.000 0.783 CA 1.880 24 residues pruned to eliminate duplicates Z: 30 40.752 2.350 0.760 0.586 0.931 0.586 CB 1.810 30 residues pruned to eliminate duplicates Z: 30 40.270 2.369 0.684 0.618 0.966 0.690 CB 1.736 30 residues pruned to eliminate duplicates Z: 28 33.404 2.312 0.607 0.523 0.963 0.593 CA 1.757 28 residues pruned to eliminate duplicates Z: 23 52.970 2.468 0.912 0.782 1.000 0.818 CB 1.867 23 residues pruned to eliminate duplicates Z: 37 39.555 2.291 0.866 0.517 0.861 0.500 CB 1.761 37 residues pruned to eliminate duplicates Z: 23 50.409 2.431 0.990 0.757 1.000 0.864 CB 1.768 23 residues pruned to eliminate duplicates Z: 81 52.887 2.330 0.585 0.608 0.900 0.675 CB 1.604 81 residues pruned to eliminate duplicates Z: 33 34.702 2.286 0.608 0.578 0.938 0.688 CB 1.651 33 residues pruned to eliminate duplicates Z: 35 33.355 2.266 0.607 0.521 0.971 0.735 CB 1.585 35 residues pruned to eliminate duplicates Z: 30 37.465 2.329 0.613 0.612 0.966 0.724 CA 1.725 30 residues pruned to eliminate duplicates Z: 78 56.913 2.349 0.579 0.630 0.961 0.675 CB 1.611 78 residues pruned to eliminate duplicates Z: 79 60.223 2.340 0.642 0.628 0.974 0.615 CB 1.616 79 residues pruned to eliminate duplicates Z: 108 63.119 2.256 0.607 0.638 0.935 0.664 CB 1.582 108 residues pruned to eliminate duplicates Z: 57 50.837 2.337 0.652 0.608 1.000 0.661 CB 1.587 57 residues pruned to eliminate duplicates Z: 79 57.653 2.368 0.560 0.619 0.962 0.679 CB 1.642 79 residues pruned to eliminate duplicates Z: 80 58.418 2.343 0.639 0.615 0.962 0.658 CB 1.595 80 residues pruned to eliminate duplicates Z: 97 61.077 2.308 0.655 0.581 0.938 0.656 CB 1.610 97 residues pruned to eliminate duplicates Z: 56 49.807 2.348 0.711 0.622 0.927 0.636 CB 1.608 56 residues pruned to eliminate duplicates Z: 78 60.774 2.374 0.636 0.623 0.974 0.675 CB 1.630 78 residues pruned to eliminate duplicates Z: 58 50.959 2.319 0.656 0.645 0.947 0.614 CB 1.620 58 residues pruned to eliminate duplicates Z: 87 61.520 2.342 0.678 0.616 0.930 0.640 CB 1.626 87 residues pruned to eliminate duplicates Z: 90 58.184 2.300 0.643 0.618 0.978 0.629 CB 1.493 90 residues pruned to eliminate duplicates Z: 57 49.513 2.321 0.720 0.592 0.946 0.696 CB 1.603 57 residues pruned to eliminate duplicates Z: 53 46.050 2.341 0.596 0.638 0.962 0.615 CB 1.561 53 residues pruned to eliminate duplicates Z: 59 53.277 2.383 0.653 0.666 0.948 0.655 CB 1.606 59 residues pruned to eliminate duplicates Z: 57 46.164 2.316 0.626 0.608 0.964 0.607 CB 1.533 57 residues pruned to eliminate duplicates Z: 144 67.631 2.252 0.702 0.556 0.902 0.601 CB 1.549 144 residues pruned to eliminate duplicates Z: 88 58.860 2.315 0.650 0.640 0.954 0.644 CB 1.518 88 residues pruned to eliminate duplicates Z: 56 52.318 2.335 0.682 0.636 0.982 0.691 CB 1.610 56 residues pruned to eliminate duplicates Z: 59 45.744 2.307 0.641 0.607 0.948 0.621 CB 1.510 59 residues pruned to eliminate duplicates Z: 114 63.693 2.274 0.628 0.609 0.938 0.681 CB 1.555 114 residues pruned to eliminate duplicates Z: 56 48.733 2.341 0.636 0.617 0.964 0.636 CB 1.593 56 residues pruned to eliminate duplicates Z: 59 46.345 2.315 0.626 0.604 0.966 0.638 CB 1.517 59 residues pruned to eliminate duplicates Z: 80 57.460 2.334 0.629 0.603 0.962 0.595 CB 1.602 80 residues pruned to eliminate duplicates Z: 98 58.682 2.300 0.627 0.581 0.928 0.691 CB 1.588 98 residues pruned to eliminate duplicates Z: 55 44.514 2.331 0.587 0.631 0.963 0.759 CB 1.503 55 residues pruned to eliminate duplicates Z: 114 66.301 2.277 0.648 0.611 0.938 0.673 CB 1.595 114 residues pruned to eliminate duplicates Z: 79 57.141 2.331 0.622 0.617 0.949 0.667 CB 1.615 79 residues pruned to eliminate duplicates Z: 90 51.792 2.288 0.564 0.614 0.933 0.674 CB 1.477 90 residues pruned to eliminate duplicates Z: 71 56.357 2.352 0.613 0.679 0.943 0.729 CB 1.597 71 residues pruned to eliminate duplicates Z: 73 57.633 2.353 0.727 0.606 0.958 0.778 CB 1.577 73 residues pruned to eliminate duplicates Z: 106 64.766 2.266 0.682 0.652 0.924 0.724 CB 1.558 106 residues pruned to eliminate duplicates Z: 58 45.172 2.217 0.741 0.609 0.877 0.667 CB 1.594 58 residues pruned to eliminate duplicates Z: 24 31.550 2.325 0.664 0.662 0.913 0.696 CB 1.602 24 residues pruned to eliminate duplicates Z: 79 60.851 2.341 0.708 0.625 0.962 0.654 CB 1.593 79 residues pruned to eliminate duplicates Z: 73 61.581 2.363 0.703 0.654 0.958 0.694 CB 1.630 73 residues pruned to eliminate duplicates Z: 80 58.051 2.327 0.724 0.607 0.949 0.620 CB 1.550 80 residues pruned to eliminate duplicates Z: 78 59.612 2.350 0.643 0.633 0.974 0.740 CB 1.595 78 residues pruned to eliminate duplicates Z: 36 34.967 2.341 0.672 0.528 0.943 0.657 CB 1.557 36 residues pruned to eliminate duplicates Z: 79 54.787 2.305 0.590 0.601 0.949 0.615 CB 1.620 79 residues pruned to eliminate duplicates Z: 113 63.378 2.259 0.716 0.591 0.929 0.634 CB 1.525 113 residues pruned to eliminate duplicates Z: 78 51.518 2.306 0.590 0.600 0.909 0.623 CB 1.602 78 residues pruned to eliminate duplicates Z: 94 60.267 2.305 0.667 0.582 0.946 0.624 CB 1.588 94 residues pruned to eliminate duplicates Z: 83 56.404 2.320 0.704 0.600 0.915 0.622 CB 1.566 83 residues pruned to eliminate duplicates Z: 27 34.440 2.291 0.825 0.567 0.923 0.692 CB 1.640 27 residues pruned to eliminate duplicates Z: 79 60.075 2.357 0.664 0.621 0.962 0.679 CB 1.609 79 residues pruned to eliminate duplicates Z: 78 60.046 2.328 0.721 0.619 0.974 0.610 CB 1.567 78 residues pruned to eliminate duplicates Z: 71 51.526 2.285 0.668 0.635 0.914 0.629 CB 1.556 71 residues pruned to eliminate duplicates Z: 25 37.444 2.356 0.822 0.640 0.958 0.500 CB 1.630 25 residues pruned to eliminate duplicates Z: 66 50.524 2.286 0.738 0.582 0.954 0.600 CB 1.529 66 residues pruned to eliminate duplicates Z: 24 36.580 2.348 0.920 0.663 0.913 0.696 CB 1.593 24 residues pruned to eliminate duplicates Z: 18 19.894 2.154 0.783 0.444 0.824 0.529 CA 1.616 18 residues pruned to eliminate duplicates Z: 45 27.600 1.992 0.642 0.552 0.818 0.568 CB 1.478 45 residues pruned to eliminate duplicates Z: 22 23.642 2.022 0.950 0.443 0.905 0.524 CB 1.534 22 residues pruned to eliminate duplicates Z: 17 23.230 2.214 0.801 0.552 0.875 0.688 CB 1.582 17 residues pruned to eliminate duplicates Z: 17 25.189 2.252 0.922 0.513 0.875 0.562 CB 1.641 17 residues pruned to eliminate duplicates Z: 40 30.182 1.931 0.733 0.561 1.000 0.641 CB 1.362 40 residues pruned to eliminate duplicates Z: 39 34.618 2.088 0.792 0.631 0.895 0.737 CB 1.483 39 residues pruned to eliminate duplicates Z: 67 48.000 2.227 0.702 0.574 0.924 0.682 CB 1.571 67 residues pruned to eliminate duplicates Z: 18 23.505 2.187 0.988 0.458 0.941 0.706 CB 1.454 18 residues pruned to eliminate duplicates Z: 17 28.096 2.183 1.195 0.543 0.875 0.688 CB 1.606 17 residues pruned to eliminate duplicates Z: 70 56.189 2.297 0.959 0.590 0.928 0.609 CB 1.487 70 residues pruned to eliminate duplicates Z: 36 35.777 2.115 0.777 0.651 0.914 0.771 CB 1.529 36 residues pruned to eliminate duplicates Z: 39 36.828 2.081 0.871 0.626 0.921 0.684 CB 1.480 39 residues pruned to eliminate duplicates Z: 39 35.597 2.101 0.852 0.610 0.868 0.605 CB 1.539 39 residues pruned to eliminate duplicates Z: 38 35.499 2.100 0.803 0.621 0.946 0.649 CB 1.453 38 residues pruned to eliminate duplicates Z: 38 34.001 2.076 0.906 0.595 0.865 0.622 CB 1.491 38 residues pruned to eliminate duplicates Z: 22 24.717 2.031 0.686 0.713 0.905 0.762 CB 1.435 22 residues pruned to eliminate duplicates Z: 24 22.876 1.910 0.714 0.638 0.913 0.739 CB 1.403 24 residues pruned to eliminate duplicates Z: 118 73.416 2.263 0.809 0.619 0.940 0.650 CB 1.576 118 residues pruned to eliminate duplicates Z: 57 48.171 2.194 0.901 0.597 0.875 0.696 CB 1.607 57 residues pruned to eliminate duplicates Z: 58 43.566 2.185 0.832 0.560 0.877 0.561 CB 1.551 58 residues pruned to eliminate duplicates Z: 41 36.155 2.100 0.923 0.601 0.900 0.650 CB 1.428 41 residues pruned to eliminate duplicates Z: 22 27.324 1.987 0.805 0.737 0.952 0.667 CB 1.411 22 residues pruned to eliminate duplicates Z: 63 42.741 2.175 0.821 0.569 0.855 0.516 CB 1.500 63 residues pruned to eliminate duplicates Z: 40 32.899 2.103 0.933 0.587 0.872 0.564 CB 1.367 40 residues pruned to eliminate duplicates Z: 22 28.217 2.019 0.795 0.776 0.952 0.714 CB 1.398 22 residues pruned to eliminate duplicates Z: 41 34.143 2.057 0.952 0.597 0.850 0.525 CB 1.441 41 residues pruned to eliminate duplicates Z: 17 30.586 1.960 0.912 0.935 1.000 0.625 CB 1.422 17 residues pruned to eliminate duplicates Z: 70 45.356 2.183 0.803 0.554 0.884 0.493 CB 1.488 70 residues pruned to eliminate duplicates Z: 39 36.495 2.084 0.846 0.631 0.895 0.553 CB 1.520 39 residues pruned to eliminate duplicates Z: 28 25.261 1.993 0.743 0.674 0.852 0.630 CB 1.400 28 residues pruned to eliminate duplicates Z: 24 25.471 1.960 0.877 0.665 0.913 0.478 CB 1.356 24 residues pruned to eliminate duplicates Z: 67 50.011 2.238 0.833 0.565 0.909 0.576 CB 1.550 67 residues pruned to eliminate duplicates Z: 34 37.389 2.346 0.780 0.487 0.939 0.606 CB 1.681 34 residues pruned to eliminate duplicates Z: 67 54.255 2.252 0.894 0.598 0.909 0.606 CB 1.568 67 residues pruned to eliminate duplicates Z: 65 48.644 2.211 0.803 0.582 0.938 0.594 CB 1.504 65 residues pruned to eliminate duplicates Z: 71 49.059 2.195 0.808 0.563 0.886 0.557 CB 1.570 71 residues pruned to eliminate duplicates Z: 22 28.868 2.428 0.703 0.527 0.905 0.381 CB 1.640 22 residues pruned to eliminate duplicates Z: 30 41.500 2.465 0.878 0.542 0.931 0.552 CB 1.716 30 residues pruned to eliminate duplicates Z: 21 34.309 2.407 0.750 0.580 0.950 0.500 CA 1.775 21 residues pruned to eliminate duplicates Z: 33 36.827 2.347 0.820 0.524 0.906 0.531 CA 1.642 33 residues pruned to eliminate duplicates Z: 11 8.966 2.166 0.645 0.260 0.900 0.400 CB 1.164 11 residues pruned to eliminate duplicates Z: 52 51.264 2.248 0.945 0.605 0.941 0.627 CB 1.579 52 residues pruned to eliminate duplicates Z: 32 34.835 2.366 0.813 0.464 0.903 0.677 CB 1.675 32 residues pruned to eliminate duplicates Z: 71 53.126 2.187 0.947 0.592 0.886 0.671 CB 1.542 71 residues pruned to eliminate duplicates Z: 37 35.674 2.264 0.782 0.449 0.944 0.611 CB 1.645 37 residues pruned to eliminate duplicates Z: 69 52.850 2.239 0.849 0.569 0.926 0.632 CB 1.563 69 residues pruned to eliminate duplicates Z: 39 31.920 2.254 0.824 0.449 0.921 0.684 CB 1.442 39 residues pruned to eliminate duplicates Z: 28 39.645 2.494 0.826 0.545 0.926 0.667 CB 1.732 28 residues pruned to eliminate duplicates Z: 66 56.636 2.281 0.901 0.596 0.908 0.631 CB 1.628 66 residues pruned to eliminate duplicates Z: 34 38.825 2.306 0.833 0.523 0.909 0.667 CB 1.719 34 residues pruned to eliminate duplicates Z: 31 36.769 2.404 0.817 0.511 0.900 0.667 CB 1.689 31 residues pruned to eliminate duplicates Z: 30 46.150 2.483 0.845 0.557 1.000 0.724 CB 1.770 30 residues pruned to eliminate duplicates Z: 24 37.482 2.436 0.773 0.613 0.957 0.739 CB 1.700 24 residues pruned to eliminate duplicates Z: 31 39.963 2.372 0.798 0.528 0.967 0.633 CB 1.721 31 residues pruned to eliminate duplicates Z: 29 43.085 2.453 0.841 0.548 1.000 0.786 CB 1.721 29 residues pruned to eliminate duplicates Z: 29 38.220 2.428 0.796 0.547 0.929 0.679 CB 1.705 29 residues pruned to eliminate duplicates Z: 32 41.815 2.405 0.824 0.543 0.968 0.677 CB 1.697 32 residues pruned to eliminate duplicates Z: 30 35.834 2.416 0.758 0.491 0.931 0.586 CB 1.698 30 residues pruned to eliminate duplicates Z: 29 31.720 2.376 0.830 0.459 0.929 0.429 CB 1.548 29 residues pruned to eliminate duplicates Z: 23 37.621 2.382 0.875 0.592 0.955 0.636 CB 1.724 23 residues pruned to eliminate duplicates Z: 23 35.171 2.368 0.723 0.601 0.955 0.727 CB 1.748 23 residues pruned to eliminate duplicates Z: 30 42.203 2.463 0.804 0.516 0.966 0.483 CB 1.798 30 residues pruned to eliminate duplicates Z: 38 37.304 2.264 0.910 0.525 0.919 0.622 CB 1.506 38 residues pruned to eliminate duplicates Z: 17 35.473 2.351 0.952 0.816 0.875 0.688 CA 1.679 17 residues pruned to eliminate duplicates Z: 30 42.926 2.241 0.915 0.612 0.966 0.690 CB 1.731 30 residues pruned to eliminate duplicates Z: 27 44.084 2.415 0.875 0.700 0.885 0.692 CB 1.798 27 residues pruned to eliminate duplicates Z: 17 38.992 2.343 1.025 0.771 1.000 0.750 CB 1.616 17 residues pruned to eliminate duplicates Z: 17 42.051 2.379 1.148 0.783 0.938 0.750 CB 1.710 17 residues pruned to eliminate duplicates Z: 29 38.888 2.282 0.908 0.617 0.929 0.607 CB 1.627 29 residues pruned to eliminate duplicates Z: 28 54.845 2.408 1.082 0.655 1.000 0.667 CB 1.824 36 residues pruned to eliminate duplicates Z: 17 44.620 2.159 1.174 0.949 1.000 0.812 CB 1.639 17 residues pruned to eliminate duplicates Z: 27 41.458 2.364 0.879 0.659 0.923 0.731 CB 1.711 27 residues pruned to eliminate duplicates Z: 15 49.971 2.495 1.060 0.943 1.000 0.857 CB 1.800 15 residues pruned to eliminate duplicates Z: 28 48.162 2.411 0.835 0.687 0.963 0.667 CB 1.833 28 residues pruned to eliminate duplicates Z: 14 46.780 2.445 1.268 0.868 0.923 0.923 CB 1.853 14 residues pruned to eliminate duplicates Z: 32 38.632 2.188 0.826 0.574 1.000 0.645 CB 1.618 32 residues pruned to eliminate duplicates Z: 28 45.099 2.390 0.815 0.643 0.926 0.704 CB 1.890 28 residues pruned to eliminate duplicates Z: 27 54.523 2.459 0.929 0.706 1.000 0.692 CB 1.868 27 residues pruned to eliminate duplicates Z: 11 27.092 2.249 0.929 0.824 0.900 0.700 CB 1.657 11 residues pruned to eliminate duplicates Z: 32 33.872 2.262 0.628 0.630 0.968 0.710 CB 1.510 32 residues pruned to eliminate duplicates Z: 74 50.789 2.179 0.909 0.577 0.918 0.603 CB 1.446 74 residues pruned to eliminate duplicates Z: 53 41.017 2.195 0.805 0.504 0.942 0.615 CB 1.517 53 residues pruned to eliminate duplicates Z: 90 53.187 2.144 0.895 0.558 0.921 0.573 CB 1.424 90 residues pruned to eliminate duplicates Z: 35 41.109 2.231 0.931 0.684 0.971 0.765 CB 1.425 35 residues pruned to eliminate duplicates Z: 35 33.639 2.204 0.757 0.637 0.882 0.471 CB 1.486 35 residues pruned to eliminate duplicates Z: 67 50.961 2.237 0.832 0.586 0.924 0.515 CB 1.525 67 residues pruned to eliminate duplicates Z: 73 48.550 2.174 0.820 0.563 0.931 0.500 CB 1.463 73 residues pruned to eliminate duplicates Z: 65 54.581 2.241 0.921 0.608 0.938 0.562 CB 1.525 65 residues pruned to eliminate duplicates Z: 18 18.768 1.988 0.819 0.579 0.941 0.353 CB 1.240 18 residues pruned to eliminate duplicates Z: 76 48.743 2.164 0.905 0.567 0.907 0.560 CB 1.411 76 residues pruned to eliminate duplicates Z: 68 53.493 2.240 0.911 0.593 0.955 0.507 CB 1.462 68 residues pruned to eliminate duplicates Z: 68 51.730 2.238 0.914 0.590 0.910 0.463 CB 1.487 68 residues pruned to eliminate duplicates Z: 61 48.887 2.171 0.935 0.583 0.983 0.617 CB 1.410 60 residues pruned to eliminate duplicates Z: 6 5.347 1.621 0.911 0.351 0.800 0.800 CA 1.134 6 residues pruned to eliminate duplicates Z: 36 35.374 2.176 0.851 0.591 0.971 0.657 CB 1.401 36 residues pruned to eliminate duplicates Z: 89 51.567 2.221 0.849 0.544 0.875 0.523 CB 1.465 89 residues pruned to eliminate duplicates Z: 162 67.054 2.169 0.751 0.561 0.907 0.652 CB 1.447 203 residues pruned to eliminate duplicates Z: 13 23.211 2.189 0.524 0.832 0.917 0.750 CB 1.646 13 residues pruned to eliminate duplicates Z: 49 35.855 2.185 0.908 0.509 0.875 0.521 CB 1.406 49 residues pruned to eliminate duplicates Z: 34 39.139 2.253 0.823 0.661 0.970 0.636 CB 1.474 34 residues pruned to eliminate duplicates Z: 20 34.804 2.270 0.811 0.702 1.000 0.737 CB 1.616 20 residues pruned to eliminate duplicates Z: 35 38.511 2.232 0.896 0.636 0.971 0.559 CB 1.415 35 residues pruned to eliminate duplicates Z: 49 43.593 2.219 0.986 0.601 0.917 0.562 CB 1.416 49 residues pruned to eliminate duplicates Z: 35 39.355 2.196 0.999 0.632 0.941 0.441 CB 1.443 35 residues pruned to eliminate duplicates Z: 34 41.975 2.252 0.982 0.671 0.970 0.576 CB 1.442 34 residues pruned to eliminate duplicates Z: 65 57.562 2.251 1.014 0.605 0.953 0.562 CB 1.506 65 residues pruned to eliminate duplicates Z: 36 40.534 2.200 1.011 0.633 1.000 0.571 CB 1.367 36 residues pruned to eliminate duplicates Z: 33 41.911 2.259 1.091 0.662 0.938 0.688 CB 1.440 33 residues pruned to eliminate duplicates Z: 19 12.952 1.856 0.835 0.434 0.833 0.667 CB 1.152 19 residues pruned to eliminate duplicates Z: 27 25.374 2.035 0.874 0.541 0.923 0.654 CB 1.358 27 residues pruned to eliminate duplicates Z: 31 23.248 2.011 0.899 0.466 0.900 0.633 CB 1.279 31 residues pruned to eliminate duplicates Z: 16 14.983 1.957 0.768 0.509 0.867 0.667 CB 1.278 16 residues pruned to eliminate duplicates Z: 25 30.438 2.102 0.942 0.584 1.000 0.708 CB 1.404 25 residues pruned to eliminate duplicates Z: 25 28.290 2.075 0.909 0.592 0.958 0.708 CB 1.393 25 residues pruned to eliminate duplicates Z: 25 31.248 2.083 1.137 0.572 0.958 0.667 CB 1.394 25 residues pruned to eliminate duplicates Z: 28 23.519 2.028 0.938 0.531 0.889 0.704 CB 1.258 28 residues pruned to eliminate duplicates Z: 25 29.160 2.044 0.959 0.586 0.958 0.667 CB 1.428 25 residues pruned to eliminate duplicates Z: 25 29.053 2.101 0.856 0.575 1.000 0.708 CB 1.415 25 residues pruned to eliminate duplicates Z: 26 25.864 2.069 0.779 0.561 0.960 0.680 CB 1.381 26 residues pruned to eliminate duplicates Z: 25 28.534 2.084 0.899 0.572 1.000 0.750 CB 1.374 25 residues pruned to eliminate duplicates Z: 26 25.051 2.036 0.843 0.549 0.960 0.640 CB 1.325 26 residues pruned to eliminate duplicates Z: 16 13.340 1.967 0.507 0.493 0.933 0.600 CB 1.255 16 residues pruned to eliminate duplicates Z: 27 25.068 2.063 0.862 0.527 0.923 0.692 CB 1.349 27 residues pruned to eliminate duplicates Z: 25 27.242 2.094 0.937 0.570 0.917 0.750 CB 1.398 25 residues pruned to eliminate duplicates Z: 28 25.113 2.006 0.876 0.488 0.926 0.667 CB 1.404 28 residues pruned to eliminate duplicates Z: 26 25.702 2.072 0.970 0.534 0.880 0.720 CB 1.384 26 residues pruned to eliminate duplicates Z: 27 21.386 2.046 0.765 0.513 0.885 0.654 CB 1.295 27 residues pruned to eliminate duplicates Z: 25 25.953 2.080 0.988 0.546 0.875 0.667 CB 1.400 25 residues pruned to eliminate duplicates Z: 25 25.110 2.075 0.781 0.569 0.917 0.667 CB 1.416 25 residues pruned to eliminate duplicates Z: 26 25.680 2.056 0.912 0.545 0.920 0.640 CB 1.359 26 residues pruned to eliminate duplicates Z: 27 23.331 2.055 0.748 0.493 0.923 0.654 CB 1.390 27 residues pruned to eliminate duplicates Z: 29 22.656 2.031 0.926 0.485 0.857 0.643 CB 1.297 29 residues pruned to eliminate duplicates Z: 99 51.591 2.140 0.764 0.563 0.908 0.643 CB 1.431 Z: 17 30.399 2.111 0.816 0.829 1.000 0.688 CA 1.492 17 residues pruned to eliminate duplicates Z: 39 33.861 2.271 0.755 0.466 0.895 0.526 CB 1.594 39 residues pruned to eliminate duplicates Z: 15 25.251 2.341 0.728 0.822 0.857 0.714 CB 1.472 15 residues pruned to eliminate duplicates Z: 76 47.675 2.195 0.776 0.569 0.880 0.547 CB 1.502 76 residues pruned to eliminate duplicates Z: 97 50.476 2.158 0.732 0.554 0.906 0.552 CB 1.443 98 residues pruned to eliminate duplicates Z: 14 35.879 2.352 0.907 0.828 1.000 0.462 CB 1.670 14 residues pruned to eliminate duplicates Z: 26 33.205 2.277 0.875 0.643 0.880 0.560 CB 1.547 25 residues pruned to eliminate duplicates Z: 17 25.987 2.061 0.719 0.814 0.938 0.688 CB 1.489 17 residues pruned to eliminate duplicates Z: 66 54.366 2.264 0.849 0.602 0.969 0.554 CB 1.508 66 residues pruned to eliminate duplicates Z: 89 47.928 2.160 0.747 0.556 0.898 0.568 CB 1.429 89 residues pruned to eliminate duplicates Z: 105 49.962 2.132 0.705 0.542 0.904 0.577 CB 1.431 204 residues pruned to eliminate duplicates Z: 73 51.761 2.236 0.740 0.571 0.958 0.556 CB 1.528 73 residues pruned to eliminate duplicates Z: 94 48.084 2.143 0.733 0.559 0.903 0.581 CB 1.404 Z: 17 29.710 2.272 0.871 0.734 0.938 0.750 CB 1.511 21 residues pruned to eliminate duplicates Z: 21 29.105 2.185 0.725 0.720 0.900 0.650 CB 1.572 22 residues pruned to eliminate duplicates Z: 6 7.616 1.874 0.307 0.783 0.800 0.400 CA 1.354 6 residues pruned to eliminate duplicates Z: 99 51.037 2.150 0.717 0.551 0.918 0.612 CB 1.446 90 residues pruned to eliminate duplicates Z: 8 8.994 1.841 0.924 0.506 0.714 0.286 CB 1.337 8 residues pruned to eliminate duplicates Z: 134 62.981 2.204 0.828 0.527 0.872 0.579 CB 1.513 232 residues pruned to eliminate duplicates Z: 68 51.597 2.250 0.865 0.589 0.925 0.612 CB 1.491 Z: 8 4.452 1.678 0.136 0.289 0.857 0.429 CB 1.306 8 residues pruned to eliminate duplicates Z: 43 34.779 2.272 0.684 0.487 0.881 0.548 CB 1.614 38 residues pruned to eliminate duplicates Z: 6 4.639 2.070 0.096 0.389 0.800 0.400 CA 1.286 6 residues pruned to eliminate duplicates Z: 60 43.664 2.301 0.822 0.529 0.831 0.492 CB 1.587 133 residues pruned to eliminate duplicates Z: 89 51.044 2.157 0.813 0.547 0.932 0.614 CB 1.427 Z: 16 32.847 2.259 0.797 0.789 1.000 0.467 CB 1.621 16 residues pruned to eliminate duplicates Z: 67 50.249 2.242 0.813 0.583 0.939 0.530 CB 1.497 67 residues pruned to eliminate duplicates Z: 71 56.264 2.280 0.929 0.589 0.929 0.571 CB 1.512 71 residues pruned to eliminate duplicates Z: 12 24.219 2.232 0.950 0.805 0.909 0.364 CB 1.414 12 residues pruned to eliminate duplicates Z: 100 47.824 2.124 0.681 0.548 0.899 0.596 CB 1.428 90 residues pruned to eliminate duplicates Z: 15 34.169 2.375 0.842 0.811 0.929 0.786 CB 1.715 15 residues pruned to eliminate duplicates Z: 79 55.784 2.261 0.890 0.552 0.923 0.577 CB 1.522 178 residues pruned to eliminate duplicates Z: 97 49.927 2.104 0.772 0.566 0.917 0.625 CB 1.399 Z: 17 31.272 2.188 1.002 0.813 0.812 0.375 CB 1.672 17 residues pruned to eliminate duplicates Z: 48 35.479 2.077 0.779 0.621 0.936 0.638 CB 1.335 48 residues pruned to eliminate duplicates Z: 82 56.165 2.225 0.886 0.556 0.926 0.630 CB 1.521 179 residues pruned to eliminate duplicates Z: 87 48.568 2.156 0.756 0.565 0.919 0.558 CB 1.414 Z: 16 29.253 2.354 0.784 0.757 0.933 0.533 CB 1.533 16 residues pruned to eliminate duplicates Z: 115 66.992 2.256 0.891 0.527 0.912 0.553 CB 1.570 202 residues pruned to eliminate duplicates Z: 78 54.213 2.249 0.866 0.560 0.935 0.610 CB 1.485 78 residues pruned to eliminate duplicates Z: 77 52.390 2.206 0.850 0.585 0.961 0.645 CB 1.413 Z: 14 20.870 1.983 0.876 0.706 1.000 0.615 CB 1.290 14 residues pruned to eliminate duplicates Z: 92 58.752 2.247 0.916 0.558 0.923 0.505 CB 1.464 169 residues pruned to eliminate duplicates Z: 115 56.192 2.156 0.813 0.544 0.895 0.544 CB 1.441 115 residues pruned to eliminate duplicates Z: 73 55.913 2.264 0.941 0.606 0.931 0.597 CB 1.457 Z: 13 16.760 1.940 0.817 0.917 1.000 0.833 CB 0.969 12 residues pruned to eliminate duplicates Z: 12 13.325 2.055 0.405 0.897 1.000 0.636 CB 0.995 12 residues pruned to eliminate duplicates Z: 84 46.553 2.215 0.831 0.529 0.831 0.506 CB 1.472 84 residues pruned to eliminate duplicates Z: 34 33.004 2.185 0.977 0.642 0.879 0.485 CB 1.325 34 residues pruned to eliminate duplicates Z: 77 47.329 2.205 0.862 0.533 0.895 0.566 CB 1.431 77 residues pruned to eliminate duplicates Z: 77 52.345 2.218 0.853 0.548 0.934 0.579 CB 1.492 73 residues pruned to eliminate duplicates Z: 13 16.949 1.959 0.941 0.866 0.917 0.583 CB 1.028 13 residues pruned to eliminate duplicates Z: 106 49.964 2.125 0.735 0.553 0.895 0.600 CB 1.403 83 residues pruned to eliminate duplicates Z: 13 15.593 2.060 0.622 0.874 0.917 0.750 CB 1.070 13 residues pruned to eliminate duplicates Z: 49 25.612 1.915 0.717 0.538 0.896 0.562 CB 1.209 49 residues pruned to eliminate duplicates Z: 89 45.777 2.122 0.730 0.550 0.909 0.557 CB 1.393 89 residues pruned to eliminate duplicates Z: 87 52.042 2.185 0.776 0.576 0.930 0.616 CB 1.445 87 residues pruned to eliminate duplicates Z: 94 51.918 2.165 0.792 0.546 0.925 0.516 CB 1.435 195 residues pruned to eliminate duplicates Z: 89 53.302 2.161 0.843 0.580 0.943 0.580 CB 1.401 Z: 6 4.117 1.492 0.844 0.295 0.800 0.600 CA 1.052 Z: 6 3.387 1.641 0.404 0.378 0.800 0.800 CA 0.936 5 residues pruned to eliminate duplicates Z: 6 5.216 1.771 0.144 0.387 1.000 0.600 CA 1.297 6 residues pruned to eliminate duplicates Z: 14 13.039 1.905 0.654 0.419 0.846 0.538 CB 1.476 14 residues pruned to eliminate duplicates Z: 13 12.287 1.817 0.665 0.451 0.917 0.500 CA 1.345 13 residues pruned to eliminate duplicates Z: 12 12.604 1.968 0.571 0.452 0.909 0.636 CA 1.420 12 residues pruned to eliminate duplicates Z: 16 20.528 2.007 0.818 0.509 0.933 0.667 CA 1.542 18 residues pruned to eliminate duplicates Z: 6 3.508 1.359 0.753 0.380 0.800 0.400 CB 0.935 6 residues pruned to eliminate duplicates Z: 18 16.219 1.893 0.688 0.471 0.941 0.529 CB 1.348 18 residues pruned to eliminate duplicates Z: 6 5.780 1.844 0.563 0.528 0.800 0.400 CB 1.091 6 residues pruned to eliminate duplicates 667 residues left after pruning, divided into chains as follows: A: 19 B: 18 C: 18 D: 207 E: 299 F: 84 G: 6 H: 16 CC for partial structure against native data = 37.96 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 3 used as input for final density modification = 0.300, Contrast = 0.490, Connect. = 0.753 for dens.mod. cycle 1 = 0.300, Contrast = 0.565, Connect. = 0.779 for dens.mod. cycle 2 = 0.300, Contrast = 0.676, Connect. = 0.807 for dens.mod. cycle 3 = 0.300, Contrast = 0.689, Connect. = 0.809 for dens.mod. cycle 4 = 0.300, Contrast = 0.703, Connect. = 0.812 for dens.mod. cycle 5 = 0.300, Contrast = 0.710, Connect. = 0.813 for dens.mod. cycle 6 = 0.300, Contrast = 0.717, Connect. = 0.815 for dens.mod. cycle 7 = 0.300, Contrast = 0.720, Connect. = 0.816 for dens.mod. cycle 8 = 0.300, Contrast = 0.723, Connect. = 0.817 for dens.mod. cycle 9 = 0.300, Contrast = 0.725, Connect. = 0.818 for dens.mod. cycle 10 TimeTaking 300.82