++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ + SHELXE - PHASING AND DENSITY MODIFICATION - Version 2019/1 + + Copyright (c) George M. Sheldrick and Isabel Uson 2001-19 + + Started at 15:56:13 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: ./1vl5-1.9-parrot-hancs/1vl5-1.9-parrot-hancs.phi -a -n -t20 Cell and symmetry only from ./1vl5-1.9-parrot-hancs/1vl5-1.9-parrot-hancs.ins Phases from ./1vl5-1.9-parrot-hancs/1vl5-1.9-parrot-hancs.phi Native data from ./1vl5-1.9-parrot-hancs/1vl5-1.9-parrot-hancs.hkl Listing output to ./1vl5-1.9-parrot-hancs/1vl5-1.9-parrot-hancs.lst Phases output to ./1vl5-1.9-parrot-hancs/1vl5-1.9-parrot-hancs.phs Poly-Ala trace output to ./1vl5-1.9-parrot-hancs/1vl5-1.9-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 94470 Reflections read from file ./1vl5-1.9-parrot-hancs/1vl5-1.9-parrot-hancs.phi 94470 Reflections read from file ./1vl5-1.9-parrot-hancs/1vl5-1.9-parrot-hancs.hkl 94470 Unique data, highest resolution = 1.850 Angstroms Anisotropic scaling: intensities multiplied by -0.000509h^2 +0.000571k^2 -0.000089l^2 +0.000000kl -0.000113hl +0.000000hk 22 Reflections with d > 2.050 and 0 in range 2.050 > d > 1.850 added Density sharpening factor set to 0.97 Fourier grid = 128 x 256 x 85 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|> = 0.718 = 0.300, Contrast = 0.412, Connect. = 0.740 for dens.mod. cycle 1 = 0.300, Contrast = 0.476, Connect. = 0.737 for dens.mod. cycle 2 = 0.300, Contrast = 0.598, Connect. = 0.769 for dens.mod. cycle 3 = 0.300, Contrast = 0.636, Connect. = 0.779 for dens.mod. cycle 4 = 0.300, Contrast = 0.660, Connect. = 0.785 for dens.mod. cycle 5 = 0.300, Contrast = 0.674, Connect. = 0.788 for dens.mod. cycle 6 = 0.300, Contrast = 0.685, Connect. = 0.791 for dens.mod. cycle 7 = 0.300, Contrast = 0.691, Connect. = 0.793 for dens.mod. cycle 8 = 0.300, Contrast = 0.697, Connect. = 0.794 for dens.mod. cycle 9 = 0.300, Contrast = 0.700, Connect. = 0.795 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 6039 peaks > 0.5 sigma used to seed fragment search Space for about 1274 unique residues taking solvent into account 1274 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 13 40.678 2.362 1.015 0.923 1.000 0.833 CA 1.734 B: 13 34.186 2.297 1.042 0.905 0.917 0.750 CA 1.633 C: 18 38.485 2.094 1.073 0.888 1.000 0.824 CB 1.549 D: 12 44.196 2.513 1.271 0.928 0.909 0.818 CB 1.799 13 residues pruned to eliminate duplicates E: 13 39.561 2.337 1.268 0.879 0.917 0.583 CA 1.705 13 residues pruned to eliminate duplicates F: 17 36.003 2.149 1.046 0.888 1.000 0.750 CB 1.476 G: 90 66.849 2.160 1.172 0.584 0.888 0.539 CB 1.569 12 residues pruned to eliminate duplicates H: 15 49.793 2.356 1.255 0.951 1.000 0.857 CB 1.727 16 residues pruned to eliminate duplicates I: 15 40.495 2.134 1.190 0.891 1.000 0.857 CA 1.664 15 residues pruned to eliminate duplicates J: 14 49.560 2.203 1.510 0.929 1.000 0.923 CA 1.739 20 residues pruned to eliminate duplicates K: 14 35.445 2.376 0.906 0.865 0.923 0.692 CB 1.722 L: 13 49.088 2.377 1.330 0.918 1.000 0.833 CA 1.804 13 residues pruned to eliminate duplicates M: 13 26.867 2.221 1.274 0.526 1.000 0.667 CB 1.496 N: 17 26.467 2.055 0.812 0.809 0.938 0.750 CA 1.449 17 residues pruned to eliminate duplicates O: 14 49.052 2.293 1.374 0.914 1.000 0.538 CA 1.767 14 residues pruned to eliminate duplicates P: 16 49.359 2.318 1.234 0.921 1.000 0.667 CB 1.732 17 residues pruned to eliminate duplicates Q: 11 17.245 2.047 0.366 0.898 0.900 0.600 CA 1.551 R: 13 33.922 2.143 1.257 0.893 0.917 0.833 CB 1.585 S: 37 45.765 2.292 1.170 0.601 0.917 0.639 CB 1.520 T: 13 38.357 2.460 1.116 0.918 0.833 0.750 CB 1.799 13 residues pruned to eliminate duplicates U: 15 38.843 2.234 1.154 0.920 1.000 0.929 CA 1.520 V: 14 33.539 2.211 1.207 0.932 1.000 0.923 CA 1.331 14 residues pruned to eliminate duplicates W: 12 44.806 2.380 1.272 0.916 1.000 0.727 CA 1.764 12 residues pruned to eliminate duplicates X: 14 29.697 2.317 0.593 0.915 1.000 0.923 CA 1.576 14 residues pruned to eliminate duplicates Y: 23 21.201 2.008 0.950 0.330 0.909 0.409 CB 1.531 Z: 14 32.416 2.261 0.984 0.799 0.923 0.692 CA 1.671 14 residues pruned to eliminate duplicates Z: 123 92.012 2.252 1.227 0.636 0.934 0.639 CB 1.565 57 residues pruned to eliminate duplicates Z: 121 80.423 2.166 1.162 0.631 0.950 0.683 CB 1.459 29 residues pruned to eliminate duplicates Z: 14 25.930 2.141 0.763 0.933 1.000 0.923 CA 1.330 Z: 16 37.017 2.275 0.955 0.923 1.000 0.867 CB 1.510 16 residues pruned to eliminate duplicates Z: 15 30.753 2.074 0.997 0.916 0.857 0.786 CB 1.635 Z: 12 32.882 2.493 0.743 0.897 0.909 0.909 CB 1.797 12 residues pruned to eliminate duplicates Z: 15 32.151 2.166 1.340 0.866 0.857 0.571 CB 1.447 15 residues pruned to eliminate duplicates Z: 13 33.822 2.241 1.080 0.916 0.917 0.833 CA 1.614 15 residues pruned to eliminate duplicates Z: 16 45.371 2.240 1.288 0.936 1.000 1.000 CB 1.592 16 residues pruned to eliminate duplicates Z: 13 39.859 2.401 1.077 0.914 1.000 0.833 CA 1.632 13 residues pruned to eliminate duplicates Z: 63 60.649 2.307 1.201 0.567 0.903 0.613 CB 1.574 63 residues pruned to eliminate duplicates Z: 17 32.240 2.160 0.910 0.882 0.938 0.875 CB 1.507 17 residues pruned to eliminate duplicates Z: 15 39.255 2.208 1.038 0.901 1.000 0.857 CA 1.663 15 residues pruned to eliminate duplicates Z: 72 66.012 2.231 1.162 0.659 0.915 0.606 CB 1.531 72 residues pruned to eliminate duplicates Z: 14 42.962 2.240 1.232 0.896 1.000 0.769 CA 1.708 14 residues pruned to eliminate duplicates Z: 23 13.250 1.978 0.644 0.250 0.818 0.409 CB 1.414 23 residues pruned to eliminate duplicates Z: 14 36.905 2.309 1.000 0.911 0.923 0.769 CA 1.702 14 residues pruned to eliminate duplicates Z: 14 38.120 2.329 1.056 0.935 1.000 0.846 CB 1.538 14 residues pruned to eliminate duplicates Z: 92 81.279 2.290 1.222 0.620 0.923 0.659 CB 1.620 85 residues pruned to eliminate duplicates Z: 13 45.168 2.385 1.317 0.927 0.917 0.667 CB 1.804 13 residues pruned to eliminate duplicates Z: 13 27.560 2.200 0.907 0.925 1.000 0.667 CA 1.331 13 residues pruned to eliminate duplicates Z: 16 45.780 2.321 1.460 0.933 0.933 0.667 CB 1.548 Z: 10 21.345 2.069 0.937 0.797 1.000 0.889 CA 1.370 Z: 16 53.211 2.297 1.539 0.938 1.000 0.667 CB 1.639 16 residues pruned to eliminate duplicates Z: 8 16.928 2.066 1.349 0.724 0.857 0.714 CB 1.257 8 residues pruned to eliminate duplicates Z: 69 58.858 2.215 1.072 0.606 0.926 0.574 CB 1.518 55 residues pruned to eliminate duplicates Z: 20 25.909 2.048 1.073 0.498 0.947 0.684 CB 1.482 20 residues pruned to eliminate duplicates Z: 84 67.645 2.235 1.123 0.563 0.940 0.687 CB 1.566 44 residues pruned to eliminate duplicates Z: 14 31.549 2.143 1.058 0.910 0.923 0.769 CA 1.524 14 residues pruned to eliminate duplicates Z: 13 37.338 2.349 1.150 0.888 1.000 0.833 CA 1.538 18 residues pruned to eliminate duplicates Z: 13 40.623 2.151 1.408 0.940 1.000 0.750 CB 1.572 12 residues pruned to eliminate duplicates Z: 17 32.205 2.232 0.758 0.900 0.875 0.688 CB 1.674 17 residues pruned to eliminate duplicates Z: 12 36.313 2.499 0.966 0.909 0.909 0.818 CB 1.741 12 residues pruned to eliminate duplicates Z: 14 47.988 2.257 1.454 0.936 1.000 0.615 CA 1.674 14 residues pruned to eliminate duplicates Z: 13 40.524 2.362 1.361 0.877 0.917 0.750 CB 1.661 13 residues pruned to eliminate duplicates Z: 12 37.347 2.416 1.077 0.922 0.909 0.818 CA 1.736 12 residues pruned to eliminate duplicates Z: 11 16.452 1.791 1.063 0.743 1.000 0.500 CA 1.133 Z: 12 13.192 1.970 0.343 0.750 0.818 0.636 CA 1.470 Z: 14 35.435 2.296 1.281 0.845 0.846 0.769 CA 1.649 14 residues pruned to eliminate duplicates Z: 87 64.950 2.143 1.148 0.615 0.930 0.547 CB 1.467 87 residues pruned to eliminate duplicates Z: 14 41.629 2.265 1.128 0.899 1.000 0.846 CA 1.712 14 residues pruned to eliminate duplicates Z: 17 42.135 2.214 1.251 0.919 1.000 0.812 CB 1.490 17 residues pruned to eliminate duplicates Z: 16 38.548 2.208 1.208 0.905 1.000 0.933 CB 1.454 16 residues pruned to eliminate duplicates Z: 9 26.055 2.232 1.038 0.858 1.000 0.750 CB 1.492 9 residues pruned to eliminate duplicates Z: 13 21.271 2.254 0.728 0.908 0.833 0.833 CA 1.343 13 residues pruned to eliminate duplicates Z: 9 23.571 2.179 1.074 0.877 1.000 0.875 CB 1.339 Z: 9 22.272 2.175 0.835 0.870 1.000 0.875 CB 1.441 9 residues pruned to eliminate duplicates Z: 19 26.200 2.275 1.010 0.443 0.889 0.444 CB 1.611 19 residues pruned to eliminate duplicates Z: 8 20.645 2.342 0.825 0.828 0.857 0.857 CB 1.603 9 residues pruned to eliminate duplicates Z: 84 64.513 2.195 1.089 0.540 0.940 0.687 CB 1.580 81 residues pruned to eliminate duplicates Z: 13 35.497 2.304 1.226 0.894 0.917 0.917 CA 1.564 13 residues pruned to eliminate duplicates Z: 16 44.147 2.322 1.198 0.911 1.000 0.667 CB 1.583 16 residues pruned to eliminate duplicates Z: 17 40.282 2.248 1.115 0.938 1.000 0.750 CB 1.472 17 residues pruned to eliminate duplicates Z: 137 90.206 2.310 1.039 0.621 0.926 0.647 CB 1.582 137 residues pruned to eliminate duplicates Z: 15 33.692 2.069 1.246 0.946 1.000 0.714 CA 1.341 Z: 13 26.891 2.173 1.412 0.520 0.917 0.750 CB 1.585 20 residues pruned to eliminate duplicates Z: 17 27.863 2.233 0.979 0.756 0.812 0.500 CA 1.545 17 residues pruned to eliminate duplicates Z: 16 43.444 2.375 1.098 0.925 1.000 0.667 CB 1.579 16 residues pruned to eliminate duplicates Z: 16 42.604 2.305 0.923 0.941 1.000 1.000 CA 1.722 16 residues pruned to eliminate duplicates Z: 12 13.068 1.924 0.358 0.807 0.909 0.818 CB 1.270 12 residues pruned to eliminate duplicates Z: 40 52.970 2.188 1.303 0.676 0.923 0.590 CB 1.550 40 residues pruned to eliminate duplicates Z: 14 20.476 2.021 0.713 0.919 0.846 0.692 CA 1.366 14 residues pruned to eliminate duplicates Z: 89 62.956 2.132 1.060 0.625 0.920 0.602 CB 1.476 40 residues pruned to eliminate duplicates Z: 13 44.714 2.389 1.142 0.943 1.000 0.583 CA 1.748 13 residues pruned to eliminate duplicates Z: 9 15.863 2.157 0.348 0.782 1.000 0.500 CB 1.504 9 residues pruned to eliminate duplicates Z: 89 68.882 2.203 1.108 0.606 0.920 0.614 CB 1.553 39 residues pruned to eliminate duplicates Z: 13 14.378 1.947 0.599 0.752 0.833 0.667 CB 1.278 12 residues pruned to eliminate duplicates Z: 15 49.717 2.332 1.506 0.943 1.000 0.643 CB 1.575 15 residues pruned to eliminate duplicates Z: 15 16.619 1.911 0.907 0.589 0.786 0.643 CB 1.423 15 residues pruned to eliminate duplicates Z: 11 14.895 1.984 1.044 0.608 0.800 0.700 CA 1.310 5 residues pruned to eliminate duplicates Z: 13 35.264 2.303 1.093 0.885 0.917 0.750 CB 1.663 13 residues pruned to eliminate duplicates Z: 61 52.607 2.179 0.992 0.553 0.967 0.667 CB 1.537 61 residues pruned to eliminate duplicates Z: 39 44.633 2.264 1.213 0.567 0.895 0.579 CB 1.514 39 residues pruned to eliminate duplicates Z: 97 63.491 2.175 0.965 0.625 0.917 0.635 CB 1.470 97 residues pruned to eliminate duplicates Z: 88 73.364 2.222 1.127 0.638 0.931 0.632 CB 1.572 88 residues pruned to eliminate duplicates Z: 15 38.623 2.152 1.219 0.950 1.000 0.786 CA 1.491 15 residues pruned to eliminate duplicates Z: 32 37.513 2.174 1.246 0.527 0.839 0.387 CB 1.601 32 residues pruned to eliminate duplicates Z: 78 56.506 2.165 1.097 0.516 0.922 0.571 CB 1.513 67 residues pruned to eliminate duplicates Z: 14 34.425 2.331 1.130 0.849 0.846 0.769 CA 1.685 14 residues pruned to eliminate duplicates Z: 12 33.020 2.241 1.205 0.898 0.909 0.727 CB 1.585 12 residues pruned to eliminate duplicates Z: 18 34.696 2.159 1.027 0.923 0.941 0.882 CB 1.436 18 residues pruned to eliminate duplicates Z: 10 20.412 1.957 1.235 0.796 0.889 0.556 CA 1.350 10 residues pruned to eliminate duplicates Z: 11 16.658 1.984 1.112 0.886 0.900 0.800 CB 1.008 Z: 14 34.692 2.300 1.107 0.926 0.923 0.692 CB 1.509 14 residues pruned to eliminate duplicates Z: 184 82.429 2.219 0.985 0.526 0.896 0.579 CB 1.506 184 residues pruned to eliminate duplicates Z: 16 41.690 2.310 1.117 0.929 1.000 0.933 CB 1.541 16 residues pruned to eliminate duplicates Z: 12 15.013 2.100 0.371 0.664 0.909 0.455 CB 1.486 12 residues pruned to eliminate duplicates Z: 9 17.252 2.190 0.903 0.828 0.875 0.750 CB 1.260 9 residues pruned to eliminate duplicates Z: 22 22.421 2.088 0.615 0.540 0.952 0.667 CA 1.465 14 residues pruned to eliminate duplicates Z: 16 42.731 2.228 1.535 0.922 0.933 0.800 CB 1.472 16 residues pruned to eliminate duplicates Z: 17 45.591 2.212 1.473 0.938 1.000 0.625 CB 1.449 17 residues pruned to eliminate duplicates Z: 91 59.879 2.256 1.019 0.507 0.900 0.622 CB 1.528 105 residues pruned to eliminate duplicates Z: 72 65.250 2.205 1.092 0.649 0.915 0.592 CB 1.597 72 residues pruned to eliminate duplicates Z: 12 38.133 2.385 1.235 0.919 0.909 0.909 CA 1.672 12 residues pruned to eliminate duplicates Z: 15 40.836 2.189 1.142 0.917 1.000 0.500 CB 1.643 15 residues pruned to eliminate duplicates Z: 13 39.244 2.154 1.296 0.938 1.000 0.917 CB 1.594 13 residues pruned to eliminate duplicates Z: 16 44.467 2.362 1.265 0.939 0.933 0.867 CB 1.597 16 residues pruned to eliminate duplicates Z: 16 24.479 2.103 0.969 0.794 0.933 0.600 CA 1.264 16 residues pruned to eliminate duplicates Z: 12 17.366 2.077 0.507 0.812 0.909 0.727 CA 1.402 12 residues pruned to eliminate duplicates Z: 58 43.102 2.148 0.991 0.494 0.912 0.667 CB 1.472 15 residues pruned to eliminate duplicates Z: 49 50.460 2.226 1.011 0.630 0.938 0.625 CB 1.537 49 residues pruned to eliminate duplicates Z: 11 17.605 1.820 1.127 0.658 1.000 0.500 CA 1.242 11 residues pruned to eliminate duplicates Z: 14 36.897 2.269 1.185 0.915 1.000 0.846 CB 1.458 14 residues pruned to eliminate duplicates Z: 112 76.465 2.229 1.081 0.606 0.919 0.667 CB 1.539 112 residues pruned to eliminate duplicates Z: 10 19.467 2.067 0.948 0.838 1.000 0.778 CB 1.204 10 residues pruned to eliminate duplicates Z: 15 30.687 2.154 0.976 0.931 1.000 0.857 CA 1.346 Z: 83 62.270 2.132 1.070 0.643 0.951 0.634 CB 1.434 83 residues pruned to eliminate duplicates Z: 15 43.858 2.316 1.658 0.946 0.929 0.929 CB 1.418 15 residues pruned to eliminate duplicates Z: 10 19.085 2.081 0.966 0.773 0.889 0.556 CA 1.374 10 residues pruned to eliminate duplicates Z: 13 33.785 2.194 1.315 0.889 0.917 0.833 CA 1.508 13 residues pruned to eliminate duplicates Z: 9 27.265 2.206 1.121 0.925 1.000 1.000 CB 1.446 9 residues pruned to eliminate duplicates Z: 14 31.824 2.078 1.254 0.912 1.000 0.538 CA 1.334 14 residues pruned to eliminate duplicates Z: 88 75.078 2.257 1.142 0.655 0.931 0.678 CB 1.548 83 residues pruned to eliminate duplicates Z: 9 22.919 2.172 1.092 0.894 1.000 0.875 CB 1.279 9 residues pruned to eliminate duplicates Z: 17 32.359 2.185 0.929 0.849 0.938 0.875 CA 1.518 17 residues pruned to eliminate duplicates Z: 17 32.877 2.253 1.033 0.912 0.875 0.750 CB 1.453 17 residues pruned to eliminate duplicates Z: 16 31.273 2.101 0.859 0.854 1.000 0.800 CA 1.526 16 residues pruned to eliminate duplicates Z: 10 22.163 1.925 1.163 0.809 1.000 0.667 CA 1.356 10 residues pruned to eliminate duplicates Z: 16 48.510 2.288 1.400 0.946 1.000 0.733 CB 1.578 16 residues pruned to eliminate duplicates Z: 60 61.874 2.260 1.205 0.576 0.949 0.593 CB 1.583 60 residues pruned to eliminate duplicates Z: 13 36.161 2.134 1.319 0.911 1.000 0.833 CB 1.494 13 residues pruned to eliminate duplicates Z: 16 47.321 2.312 1.290 0.941 1.000 0.667 CB 1.601 16 residues pruned to eliminate duplicates Z: 84 59.295 2.097 1.067 0.608 0.916 0.663 CB 1.481 84 residues pruned to eliminate duplicates Z: 14 33.889 2.147 1.222 0.937 1.000 1.000 CB 1.371 14 residues pruned to eliminate duplicates Z: 11 13.622 1.667 0.905 0.831 1.000 0.700 CB 1.019 11 residues pruned to eliminate duplicates Z: 10 20.633 1.940 1.127 0.769 1.000 0.778 CA 1.314 10 residues pruned to eliminate duplicates Z: 27 28.663 2.052 1.106 0.535 0.923 0.577 CB 1.362 27 residues pruned to eliminate duplicates Z: 55 66.166 2.342 1.320 0.633 0.944 0.685 CB 1.549 55 residues pruned to eliminate duplicates Z: 39 39.912 2.181 1.149 0.571 0.895 0.579 CB 1.441 26 residues pruned to eliminate duplicates Z: 9 17.658 2.071 0.554 0.922 1.000 0.750 CB 1.364 Z: 29 16.117 1.933 0.895 0.397 0.786 0.607 CB 1.179 13 residues pruned to eliminate duplicates Z: 87 59.392 2.062 1.118 0.600 0.919 0.593 CB 1.451 87 residues pruned to eliminate duplicates Z: 9 13.873 1.953 1.046 0.649 0.750 0.750 CB 1.424 9 residues pruned to eliminate duplicates Z: 16 47.220 2.293 1.133 0.936 1.000 0.867 CB 1.736 16 residues pruned to eliminate duplicates Z: 88 61.874 2.123 1.089 0.625 0.920 0.632 CB 1.446 88 residues pruned to eliminate duplicates Z: 14 30.864 2.088 1.039 0.872 1.000 0.769 CA 1.466 14 residues pruned to eliminate duplicates Z: 17 27.053 2.039 1.226 0.557 1.000 0.688 CB 1.411 19 residues pruned to eliminate duplicates Z: 100 80.041 2.309 1.115 0.602 0.929 0.657 CB 1.609 100 residues pruned to eliminate duplicates Z: 15 47.309 2.320 1.483 0.954 1.000 0.571 CB 1.510 15 residues pruned to eliminate duplicates Z: 16 31.838 2.024 1.099 0.908 0.933 0.933 CB 1.473 16 residues pruned to eliminate duplicates Z: 63 73.678 2.305 1.239 0.646 0.968 0.677 CB 1.635 63 residues pruned to eliminate duplicates Z: 54 49.735 2.169 1.115 0.632 0.887 0.566 CB 1.483 54 residues pruned to eliminate duplicates Z: 15 35.626 2.180 1.110 0.917 1.000 0.786 CA 1.461 15 residues pruned to eliminate duplicates Z: 20 36.968 2.247 0.987 0.826 0.947 0.789 CB 1.511 20 residues pruned to eliminate duplicates Z: 114 82.562 2.178 1.132 0.653 0.965 0.673 CB 1.505 118 residues pruned to eliminate duplicates Z: 16 48.272 2.311 1.532 0.940 1.000 0.733 CB 1.480 16 residues pruned to eliminate duplicates Z: 8 12.794 1.797 0.740 0.730 1.000 1.000 CA 1.257 Z: 87 70.046 2.231 1.092 0.620 0.919 0.651 CB 1.573 87 residues pruned to eliminate duplicates Z: 9 19.549 2.185 0.655 0.887 1.000 0.875 CB 1.379 9 residues pruned to eliminate duplicates Z: 11 17.681 1.893 1.135 0.690 1.000 0.600 CA 1.162 11 residues pruned to eliminate duplicates Z: 13 39.901 2.190 1.305 0.914 1.000 0.750 CB 1.613 13 residues pruned to eliminate duplicates Z: 63 56.072 2.279 1.037 0.578 0.871 0.677 CB 1.634 63 residues pruned to eliminate duplicates Z: 26 26.110 2.142 0.808 0.597 0.840 0.600 CB 1.463 26 residues pruned to eliminate duplicates Z: 10 16.495 1.977 1.085 0.672 0.889 0.556 CA 1.280 10 residues pruned to eliminate duplicates Z: 8 18.532 2.312 0.700 0.773 0.857 0.714 CB 1.633 8 residues pruned to eliminate duplicates Z: 36 22.839 1.972 0.784 0.440 0.943 0.600 CB 1.238 22 residues pruned to eliminate duplicates Z: 14 16.454 1.908 0.868 0.920 0.923 0.846 CB 0.977 14 residues pruned to eliminate duplicates Z: 17 34.268 2.246 0.863 0.906 1.000 0.875 CB 1.456 17 residues pruned to eliminate duplicates Z: 158 91.652 2.225 1.042 0.596 0.943 0.618 CB 1.559 156 residues pruned to eliminate duplicates Z: 17 44.602 2.249 1.332 0.924 1.000 0.812 CB 1.494 17 residues pruned to eliminate duplicates Z: 15 28.240 2.019 1.252 0.920 1.000 0.500 CB 1.168 15 residues pruned to eliminate duplicates Z: 16 34.487 2.110 1.127 0.924 1.000 0.800 CA 1.393 16 residues pruned to eliminate duplicates Z: 24 24.511 2.137 0.905 0.396 0.957 0.565 CB 1.465 24 residues pruned to eliminate duplicates Z: 90 62.238 2.087 1.101 0.638 0.921 0.618 CB 1.434 90 residues pruned to eliminate duplicates Z: 10 15.837 1.767 0.768 0.798 1.000 0.778 CB 1.302 10 residues pruned to eliminate duplicates Z: 39 31.646 2.135 0.976 0.491 0.842 0.553 CB 1.459 34 residues pruned to eliminate duplicates Z: 68 59.247 2.116 1.163 0.690 0.940 0.687 CB 1.414 68 residues pruned to eliminate duplicates Z: 145 92.200 2.293 1.045 0.611 0.924 0.611 CB 1.596 107 residues pruned to eliminate duplicates Z: 159 92.486 2.283 1.081 0.576 0.899 0.646 CB 1.602 159 residues pruned to eliminate duplicates Z: 17 27.884 2.229 0.806 0.760 0.875 0.625 CA 1.571 17 residues pruned to eliminate duplicates Z: 89 73.739 2.190 1.211 0.643 0.932 0.602 CB 1.524 89 residues pruned to eliminate duplicates Z: 15 23.746 2.105 1.012 0.820 0.786 0.786 CA 1.445 15 residues pruned to eliminate duplicates Z: 17 42.471 2.172 1.223 0.903 1.000 0.812 CB 1.567 17 residues pruned to eliminate duplicates Z: 22 19.571 2.074 0.835 0.507 0.857 0.524 CB 1.300 22 residues pruned to eliminate duplicates Z: 9 26.170 2.136 1.265 0.789 1.000 0.750 CB 1.484 9 residues pruned to eliminate duplicates Z: 13 36.801 2.279 1.214 0.903 0.917 0.750 CA 1.638 13 residues pruned to eliminate duplicates Z: 13 35.471 2.272 1.350 0.868 0.917 0.833 CA 1.529 13 residues pruned to eliminate duplicates Z: 143 93.025 2.286 1.124 0.611 0.915 0.606 CB 1.581 143 residues pruned to eliminate duplicates Z: 10 22.558 2.150 0.739 0.927 1.000 0.778 CB 1.409 11 residues pruned to eliminate duplicates Z: 14 35.698 2.203 0.997 0.920 1.000 0.923 CB 1.586 14 residues pruned to eliminate duplicates Z: 16 47.683 2.212 1.455 0.928 1.000 0.933 CA 1.588 16 residues pruned to eliminate duplicates Z: 15 39.212 2.144 1.260 0.942 1.000 0.786 CB 1.499 15 residues pruned to eliminate duplicates Z: 68 68.324 2.265 1.190 0.644 0.940 0.612 CB 1.564 68 residues pruned to eliminate duplicates Z: 13 33.768 2.399 0.848 0.927 0.917 0.833 CA 1.681 13 residues pruned to eliminate duplicates Z: 17 18.806 1.929 0.682 0.607 0.938 0.562 CB 1.396 Z: 144 84.159 2.198 1.124 0.594 0.916 0.601 CB 1.505 144 residues pruned to eliminate duplicates Z: 12 18.913 2.017 0.516 0.805 1.000 0.727 CA 1.430 12 residues pruned to eliminate duplicates Z: 16 49.223 2.341 1.335 0.933 0.933 0.533 CB 1.738 16 residues pruned to eliminate duplicates Z: 14 27.613 2.132 1.080 0.900 1.000 0.462 CB 1.233 14 residues pruned to eliminate duplicates Z: 18 30.229 1.907 1.132 0.893 0.941 0.647 CA 1.375 18 residues pruned to eliminate duplicates Z: 10 19.885 1.941 1.006 0.864 1.000 0.556 CA 1.248 10 residues pruned to eliminate duplicates Z: 6 9.172 1.642 0.745 0.808 1.000 1.000 CA 1.094 6 residues pruned to eliminate duplicates Z: 16 43.611 2.248 1.628 0.928 0.933 0.667 CB 1.430 16 residues pruned to eliminate duplicates Z: 25 20.637 2.082 0.938 0.337 0.875 0.625 CB 1.426 25 residues pruned to eliminate duplicates Z: 14 34.867 2.101 1.277 0.947 1.000 0.615 CB 1.397 14 residues pruned to eliminate duplicates Z: 9 16.379 2.212 0.837 0.575 0.875 0.625 CB 1.515 Z: 8 9.234 2.058 0.697 0.412 0.857 0.714 CB 1.280 11 residues pruned to eliminate duplicates Z: 17 43.110 2.194 1.344 0.934 1.000 0.812 CB 1.461 17 residues pruned to eliminate duplicates Z: 25 14.117 2.034 0.581 0.467 0.750 0.500 CB 1.235 24 residues pruned to eliminate duplicates Z: 11 18.982 1.796 1.260 0.793 1.000 0.600 CA 1.144 11 residues pruned to eliminate duplicates Z: 14 30.130 2.173 0.777 0.894 0.923 0.846 CA 1.683 14 residues pruned to eliminate duplicates Z: 14 38.543 2.267 0.983 0.894 1.000 0.923 CA 1.706 14 residues pruned to eliminate duplicates Z: 34 44.469 2.266 1.117 0.599 0.879 0.667 CA 1.671 34 residues pruned to eliminate duplicates Z: 14 18.394 2.066 0.557 0.894 0.846 0.692 CB 1.345 14 residues pruned to eliminate duplicates Z: 62 57.541 2.307 1.128 0.572 0.885 0.574 CB 1.581 62 residues pruned to eliminate duplicates Z: 12 19.913 2.118 1.172 0.339 1.000 0.636 CA 1.555 12 residues pruned to eliminate duplicates Z: 11 20.922 1.906 1.075 0.806 1.000 0.800 CB 1.281 11 residues pruned to eliminate duplicates Z: 15 22.832 2.213 0.928 0.554 0.929 0.643 CB 1.461 15 residues pruned to eliminate duplicates Z: 11 16.284 1.978 0.937 0.898 0.900 0.600 CB 1.068 11 residues pruned to eliminate duplicates Z: 9 20.552 2.086 1.055 0.797 1.000 0.750 CA 1.307 9 residues pruned to eliminate duplicates Z: 17 28.507 1.954 0.908 0.905 1.000 0.750 CA 1.361 17 residues pruned to eliminate duplicates Z: 10 19.874 2.206 0.863 0.787 0.889 0.667 CB 1.409 10 residues pruned to eliminate duplicates Z: 10 14.183 1.909 0.498 0.871 1.000 0.667 CB 1.205 10 residues pruned to eliminate duplicates Z: 61 37.069 2.059 0.826 0.468 0.900 0.567 CB 1.461 68 residues pruned to eliminate duplicates Z: 17 32.920 2.247 1.123 0.600 1.000 0.750 CB 1.569 18 residues pruned to eliminate duplicates Z: 17 38.975 2.177 1.203 0.940 1.000 0.938 CB 1.411 17 residues pruned to eliminate duplicates Z: 85 69.603 2.194 1.131 0.647 0.905 0.595 CB 1.565 85 residues pruned to eliminate duplicates Z: 16 44.266 2.252 1.332 0.931 1.000 0.733 CB 1.520 16 residues pruned to eliminate duplicates Z: 88 73.229 2.156 1.212 0.679 0.966 0.701 CB 1.446 88 residues pruned to eliminate duplicates Z: 115 71.749 2.157 1.029 0.628 0.939 0.649 CB 1.450 115 residues pruned to eliminate duplicates Z: 15 19.835 1.967 0.624 0.858 0.929 0.714 CA 1.316 15 residues pruned to eliminate duplicates Z: 16 18.384 2.061 0.918 0.578 0.867 0.533 CB 1.285 16 residues pruned to eliminate duplicates Z: 14 34.786 2.165 1.120 0.907 1.000 0.615 CA 1.494 14 residues pruned to eliminate duplicates Z: 14 17.976 1.944 1.101 0.467 0.923 0.615 CB 1.367 14 residues pruned to eliminate duplicates Z: 11 13.308 1.974 0.980 0.367 1.000 0.500 CB 1.242 11 residues pruned to eliminate duplicates Z: 13 32.541 2.162 1.200 0.943 1.000 0.917 CB 1.369 13 residues pruned to eliminate duplicates Z: 13 38.601 2.204 1.327 0.931 1.000 0.667 CA 1.519 13 residues pruned to eliminate duplicates Z: 12 14.725 1.664 0.982 0.776 1.000 0.727 CB 1.055 12 residues pruned to eliminate duplicates Z: 84 59.473 2.084 1.138 0.655 0.904 0.663 CB 1.404 84 residues pruned to eliminate duplicates Z: 13 31.463 2.209 0.872 0.928 1.000 1.000 CA 1.538 13 residues pruned to eliminate duplicates Z: 14 11.792 1.838 0.575 0.261 1.000 0.538 CA 1.486 Z: 16 38.659 2.060 1.312 0.920 1.000 0.667 CA 1.476 16 residues pruned to eliminate duplicates Z: 112 77.429 2.194 1.091 0.643 0.946 0.685 CB 1.481 112 residues pruned to eliminate duplicates Z: 57 63.311 2.280 1.194 0.611 0.964 0.571 CB 1.578 57 residues pruned to eliminate duplicates Z: 12 17.983 1.894 0.648 0.890 1.000 0.727 CB 1.250 11 residues pruned to eliminate duplicates Z: 12 17.919 2.059 0.355 0.810 1.000 0.818 CA 1.478 12 residues pruned to eliminate duplicates Z: 16 37.102 2.093 1.229 0.906 1.000 0.800 CA 1.461 16 residues pruned to eliminate duplicates Z: 109 73.599 2.140 1.136 0.646 0.935 0.704 CB 1.446 109 residues pruned to eliminate duplicates Z: 82 58.552 2.206 1.033 0.530 0.901 0.617 CB 1.564 82 residues pruned to eliminate duplicates Z: 17 36.441 2.152 0.894 0.903 1.000 0.875 CB 1.593 17 residues pruned to eliminate duplicates Z: 6 4.237 1.548 0.806 0.468 0.800 0.400 CB 0.875 Z: 6 2.350 1.826 0.328 0.448 0.600 0.600 CB 0.762 6 residues pruned to eliminate duplicates Z: 15 30.123 2.107 0.999 0.920 1.000 0.857 CB 1.346 15 residues pruned to eliminate duplicates Z: 15 25.259 1.984 0.714 0.922 1.000 0.714 CB 1.396 Z: 12 29.376 2.209 1.105 0.908 0.909 0.727 CB 1.488 12 residues pruned to eliminate duplicates Z: 14 41.860 2.191 1.190 0.929 1.000 0.846 CA 1.693 14 residues pruned to eliminate duplicates Z: 14 20.120 1.917 0.786 0.917 1.000 0.769 CB 1.150 14 residues pruned to eliminate duplicates Z: 10 10.687 1.808 0.780 0.461 0.778 0.444 C 1.481 10 residues pruned to eliminate duplicates Z: 74 63.731 2.188 1.149 0.629 0.932 0.589 CB 1.509 74 residues pruned to eliminate duplicates Z: 7 14.127 2.149 0.935 0.544 0.833 0.833 CA 1.595 7 residues pruned to eliminate duplicates Z: 71 61.848 2.220 0.928 0.670 0.943 0.743 CB 1.565 71 residues pruned to eliminate duplicates Z: 15 27.170 2.296 0.865 0.790 0.857 0.500 CB 1.534 15 residues pruned to eliminate duplicates Z: 83 64.141 2.146 1.141 0.659 0.951 0.683 CB 1.398 83 residues pruned to eliminate duplicates Z: 31 24.979 2.033 0.877 0.491 0.933 0.600 CB 1.293 22 residues pruned to eliminate duplicates Z: 11 20.302 1.918 0.995 0.805 1.000 0.700 CB 1.286 11 residues pruned to eliminate duplicates Z: 17 30.105 1.955 0.973 0.910 1.000 0.812 CA 1.384 17 residues pruned to eliminate duplicates Z: 12 38.731 2.388 1.236 0.901 0.909 0.818 CB 1.717 12 residues pruned to eliminate duplicates Z: 33 22.774 1.956 0.657 0.485 0.875 0.656 CB 1.441 33 residues pruned to eliminate duplicates Z: 37 45.880 2.146 1.164 0.596 1.000 0.694 CB 1.503 37 residues pruned to eliminate duplicates Z: 10 19.506 1.974 0.989 0.784 1.000 0.778 CA 1.289 10 residues pruned to eliminate duplicates Z: 137 82.629 2.210 1.011 0.628 0.934 0.684 CB 1.514 137 residues pruned to eliminate duplicates Z: 67 51.178 2.083 1.055 0.614 0.894 0.652 CB 1.478 67 residues pruned to eliminate duplicates Z: 10 13.054 2.132 0.798 0.432 0.778 0.444 CB 1.566 10 residues pruned to eliminate duplicates Z: 12 21.321 2.003 0.550 0.839 1.000 0.727 CA 1.547 12 residues pruned to eliminate duplicates Z: 12 13.741 1.812 0.420 0.915 1.000 0.909 CB 1.138 12 residues pruned to eliminate duplicates Z: 78 66.036 2.202 1.058 0.613 0.948 0.623 CB 1.574 78 residues pruned to eliminate duplicates Z: 14 44.652 2.220 1.489 0.933 1.000 0.769 CB 1.564 14 residues pruned to eliminate duplicates Z: 11 18.813 1.966 0.491 0.910 1.000 1.000 CB 1.440 11 residues pruned to eliminate duplicates Z: 11 13.232 1.950 0.666 0.543 0.900 0.800 CA 1.371 11 residues pruned to eliminate duplicates Z: 15 50.609 2.204 1.436 0.936 1.000 0.786 CA 1.754 15 residues pruned to eliminate duplicates Z: 17 47.907 2.279 1.430 0.936 1.000 0.688 CB 1.506 17 residues pruned to eliminate duplicates Z: 36 51.326 2.243 1.212 0.616 0.971 0.714 CB 1.613 36 residues pruned to eliminate duplicates Z: 23 24.134 2.058 0.991 0.526 0.818 0.636 CA 1.496 23 residues pruned to eliminate duplicates Z: 16 35.022 2.096 1.218 0.915 0.933 0.800 CA 1.473 16 residues pruned to eliminate duplicates Z: 56 38.975 2.038 1.010 0.571 0.873 0.673 CB 1.373 56 residues pruned to eliminate duplicates Z: 8 6.832 1.759 0.570 0.512 0.857 0.714 CA 1.078 5 residues pruned to eliminate duplicates Z: 16 29.808 2.145 1.111 0.798 0.933 0.733 CA 1.403 16 residues pruned to eliminate duplicates Z: 13 40.438 2.227 1.333 0.925 1.000 0.917 CB 1.576 13 residues pruned to eliminate duplicates Z: 11 19.287 1.835 1.139 0.831 0.900 0.700 CA 1.297 11 residues pruned to eliminate duplicates Z: 15 34.667 2.139 1.247 0.923 0.929 0.714 CB 1.459 15 residues pruned to eliminate duplicates Z: 15 27.934 2.115 1.080 0.913 1.000 0.714 CB 1.202 15 residues pruned to eliminate duplicates Z: 20 39.050 2.311 1.175 0.705 0.895 0.474 CB 1.652 20 residues pruned to eliminate duplicates Z: 15 24.019 1.995 0.861 0.890 0.929 0.643 CB 1.339 15 residues pruned to eliminate duplicates Z: 15 20.520 1.875 0.848 0.936 1.000 0.643 CB 1.103 15 residues pruned to eliminate duplicates Z: 14 19.226 1.917 0.720 0.860 0.923 0.692 CB 1.288 Z: 17 39.714 2.287 1.311 0.904 0.875 0.562 CB 1.528 17 residues pruned to eliminate duplicates Z: 70 64.304 2.235 1.027 0.681 0.928 0.652 CB 1.561 70 residues pruned to eliminate duplicates Z: 12 30.343 2.306 0.742 0.926 1.000 0.909 CA 1.597 12 residues pruned to eliminate duplicates Z: 6 4.934 1.850 -0.293 0.659 1.000 0.800 CB 1.455 Z: 157 78.466 2.105 1.012 0.585 0.923 0.590 CB 1.481 154 residues pruned to eliminate duplicates Z: 9 18.088 2.069 0.989 0.791 0.875 0.875 CA 1.376 9 residues pruned to eliminate duplicates Z: 10 14.049 2.023 0.630 0.857 0.889 0.778 CB 1.178 10 residues pruned to eliminate duplicates Z: 9 28.455 2.212 1.201 0.918 1.000 0.875 CB 1.457 9 residues pruned to eliminate duplicates Z: 17 34.535 2.000 1.150 0.915 1.000 0.750 CA 1.418 17 residues pruned to eliminate duplicates Z: 109 75.520 2.174 1.098 0.635 0.954 0.657 CB 1.472 109 residues pruned to eliminate duplicates Z: 10 16.173 1.971 0.740 0.784 0.889 0.444 CA 1.377 10 residues pruned to eliminate duplicates Z: 83 77.030 2.255 1.248 0.654 0.939 0.646 CB 1.549 83 residues pruned to eliminate duplicates Z: 14 30.158 2.112 1.064 0.888 1.000 0.846 CB 1.383 14 residues pruned to eliminate duplicates Z: 13 22.597 1.955 0.761 0.840 1.000 0.583 CB 1.415 13 residues pruned to eliminate duplicates Z: 66 63.486 2.331 1.082 0.580 0.923 0.631 CB 1.628 66 residues pruned to eliminate duplicates Z: 16 51.618 2.281 1.504 0.940 1.000 0.733 CB 1.621 16 residues pruned to eliminate duplicates Z: 7 6.122 1.566 0.821 0.356 0.833 0.500 CA 1.228 9 residues pruned to eliminate duplicates Z: 17 31.706 1.963 1.056 0.898 1.000 0.875 CA 1.404 17 residues pruned to eliminate duplicates Z: 9 13.553 2.074 0.409 0.793 0.875 0.750 CB 1.450 9 residues pruned to eliminate duplicates Z: 14 32.320 2.201 0.929 0.900 1.000 0.615 CB 1.508 14 residues pruned to eliminate duplicates Z: 81 72.007 2.253 1.063 0.654 0.950 0.637 CB 1.579 81 residues pruned to eliminate duplicates Z: 159 82.527 2.182 0.968 0.567 0.949 0.658 CB 1.510 159 residues pruned to eliminate duplicates Z: 16 20.463 1.910 0.701 0.626 1.000 0.867 CB 1.445 16 residues pruned to eliminate duplicates Z: 16 44.232 2.255 1.357 0.928 1.000 0.733 CB 1.505 16 residues pruned to eliminate duplicates Z: 9 11.941 1.755 1.037 0.609 0.875 0.625 CA 1.217 6 residues pruned to eliminate duplicates Z: 14 15.938 1.870 0.302 0.920 1.000 0.923 CB 1.279 14 residues pruned to eliminate duplicates Z: 24 19.782 2.043 0.864 0.377 0.826 0.565 CB 1.495 24 residues pruned to eliminate duplicates Z: 14 30.671 2.194 0.689 0.931 1.000 1.000 CA 1.605 14 residues pruned to eliminate duplicates Z: 13 30.915 2.221 1.035 0.870 0.833 0.750 CB 1.730 13 residues pruned to eliminate duplicates Z: 78 61.225 2.107 1.179 0.627 0.922 0.662 CB 1.463 78 residues pruned to eliminate duplicates Z: 71 66.623 2.267 1.231 0.632 0.900 0.614 CB 1.545 71 residues pruned to eliminate duplicates Z: 9 18.587 2.061 1.044 0.801 0.875 0.750 CB 1.370 9 residues pruned to eliminate duplicates Z: 120 73.267 2.247 1.006 0.548 0.958 0.664 CB 1.484 120 residues pruned to eliminate duplicates Z: 14 8.795 1.882 0.365 0.522 0.769 0.692 CB 1.207 14 residues pruned to eliminate duplicates Z: 9 14.908 2.022 1.237 0.572 1.000 0.625 CA 1.087 9 residues pruned to eliminate duplicates Z: 16 54.174 2.332 1.463 0.946 1.000 0.533 CB 1.684 16 residues pruned to eliminate duplicates Z: 10 23.884 2.182 0.782 0.926 1.000 1.000 CB 1.436 9 residues pruned to eliminate duplicates Z: 16 50.796 2.303 1.520 0.940 1.000 0.600 CB 1.569 16 residues pruned to eliminate duplicates Z: 145 92.514 2.276 1.060 0.605 0.938 0.701 CB 1.588 145 residues pruned to eliminate duplicates Z: 16 22.893 1.954 0.924 0.823 0.933 0.733 CB 1.273 16 residues pruned to eliminate duplicates Z: 7 9.791 2.090 0.841 0.488 0.833 0.667 CB 1.262 7 residues pruned to eliminate duplicates Z: 18 26.476 2.065 1.032 0.554 1.000 0.647 CB 1.452 20 residues pruned to eliminate duplicates Z: 7 9.799 1.813 0.392 0.703 1.000 0.667 CA 1.318 7 residues pruned to eliminate duplicates Z: 64 58.724 2.234 1.091 0.569 0.952 0.603 CB 1.555 64 residues pruned to eliminate duplicates Z: 12 31.741 2.289 0.837 0.926 1.000 1.000 CB 1.597 12 residues pruned to eliminate duplicates Z: 12 25.406 2.285 1.207 0.778 0.727 0.545 CB 1.635 12 residues pruned to eliminate duplicates Z: 27 41.116 2.314 1.397 0.639 0.808 0.577 CB 1.579 27 residues pruned to eliminate duplicates Z: 17 18.221 1.926 0.699 0.591 0.938 0.688 CB 1.361 17 residues pruned to eliminate duplicates Z: 16 26.388 2.086 0.879 0.909 0.933 0.667 CA 1.322 16 residues pruned to eliminate duplicates Z: 17 38.057 1.987 1.323 0.932 1.000 0.750 CA 1.439 17 residues pruned to eliminate duplicates Z: 16 40.629 2.235 1.374 0.871 1.000 0.733 CB 1.441 16 residues pruned to eliminate duplicates Z: 9 11.912 1.993 1.033 0.504 0.750 0.625 CB 1.379 9 residues pruned to eliminate duplicates Z: 85 60.637 2.169 1.047 0.577 0.940 0.619 CB 1.471 85 residues pruned to eliminate duplicates Z: 13 20.779 2.050 1.161 0.344 1.000 0.500 CB 1.604 13 residues pruned to eliminate duplicates Z: 12 15.446 1.981 0.250 0.945 1.000 1.000 CA 1.302 12 residues pruned to eliminate duplicates Z: 86 76.276 2.260 1.113 0.684 0.929 0.541 CB 1.574 86 residues pruned to eliminate duplicates Z: 16 26.296 1.970 0.930 0.883 1.000 0.733 CB 1.291 16 residues pruned to eliminate duplicates Z: 11 5.069 1.746 0.125 0.520 0.700 0.600 CB 1.144 Z: 7 6.863 1.709 0.294 0.747 0.833 0.667 CB 1.219 7 residues pruned to eliminate duplicates Z: 87 62.382 2.279 1.025 0.517 0.919 0.674 CB 1.560 87 residues pruned to eliminate duplicates Z: 89 70.209 2.181 1.110 0.659 0.955 0.636 CB 1.470 89 residues pruned to eliminate duplicates Z: 33 51.587 2.304 1.358 0.631 0.906 0.750 CB 1.637 33 residues pruned to eliminate duplicates Z: 115 82.849 2.169 1.223 0.639 0.947 0.658 CB 1.491 115 residues pruned to eliminate duplicates Z: 115 66.446 2.216 0.904 0.533 0.939 0.684 CB 1.521 115 residues pruned to eliminate duplicates Z: 31 19.875 2.005 0.785 0.423 0.833 0.500 CB 1.318 31 residues pruned to eliminate duplicates Z: 132 83.713 2.275 1.045 0.600 0.916 0.664 CB 1.560 132 residues pruned to eliminate duplicates Z: 9 14.329 2.134 0.264 0.876 1.000 0.500 CB 1.365 9 residues pruned to eliminate duplicates Z: 103 72.684 2.206 1.109 0.634 0.902 0.647 CB 1.513 103 residues pruned to eliminate duplicates Z: 15 47.485 2.288 1.465 0.944 1.000 0.929 CB 1.558 15 residues pruned to eliminate duplicates Z: 10 15.561 2.060 0.526 0.881 1.000 0.667 CB 1.194 10 residues pruned to eliminate duplicates Z: 76 44.896 2.037 0.925 0.523 0.907 0.627 CB 1.425 76 residues pruned to eliminate duplicates Z: 163 88.439 2.255 1.104 0.554 0.895 0.599 CB 1.551 163 residues pruned to eliminate duplicates Z: 16 54.311 2.372 1.575 0.945 1.000 0.667 CB 1.589 16 residues pruned to eliminate duplicates Z: 75 63.604 2.207 1.180 0.591 0.892 0.635 CB 1.580 75 residues pruned to eliminate duplicates Z: 43 44.592 2.131 1.068 0.650 0.952 0.500 CB 1.425 43 residues pruned to eliminate duplicates Z: 12 16.947 1.706 0.929 0.771 1.000 0.727 CA 1.222 12 residues pruned to eliminate duplicates Z: 14 31.047 2.373 1.094 0.569 1.000 0.769 CB 1.621 14 residues pruned to eliminate duplicates Z: 11 12.876 1.868 0.382 0.919 1.000 0.800 CB 1.112 11 residues pruned to eliminate duplicates Z: 12 34.333 2.287 1.250 0.911 0.909 0.727 CB 1.568 12 residues pruned to eliminate duplicates Z: 82 66.668 2.156 1.162 0.660 0.914 0.617 CB 1.499 82 residues pruned to eliminate duplicates Z: 55 28.018 1.898 0.687 0.482 0.926 0.593 CB 1.310 46 residues pruned to eliminate duplicates Z: 14 20.450 1.901 0.829 0.905 0.923 0.769 CB 1.257 14 residues pruned to eliminate duplicates Z: 10 8.036 1.796 0.660 0.430 0.667 0.444 CA 1.449 9 residues pruned to eliminate duplicates Z: 18 14.782 1.979 0.700 0.356 0.824 0.647 CA 1.511 18 residues pruned to eliminate duplicates Z: 60 55.717 2.176 1.163 0.608 0.932 0.644 CB 1.492 60 residues pruned to eliminate duplicates Z: 7 11.266 1.845 0.425 0.895 1.000 1.000 CB 1.253 Z: 10 14.092 1.883 0.944 0.761 0.889 0.556 CB 1.145 10 residues pruned to eliminate duplicates Z: 60 57.651 2.257 1.174 0.570 0.915 0.576 CB 1.561 60 residues pruned to eliminate duplicates Z: 119 79.224 2.155 1.110 0.637 0.941 0.653 CB 1.501 119 residues pruned to eliminate duplicates Z: 9 21.837 2.192 0.742 0.915 1.000 1.000 CB 1.429 9 residues pruned to eliminate duplicates Z: 82 75.933 2.247 1.174 0.671 0.926 0.605 CB 1.593 98 residues pruned to eliminate duplicates Z: 10 7.102 1.861 0.574 0.355 0.889 0.444 CA 1.064 10 residues pruned to eliminate duplicates Z: 6 4.159 1.828 -0.166 0.713 0.800 0.600 CB 1.257 6 residues pruned to eliminate duplicates Z: 16 33.050 2.095 1.043 0.910 0.933 0.733 CA 1.515 16 residues pruned to eliminate duplicates Z: 81 65.886 2.204 1.118 0.628 0.925 0.637 CB 1.513 81 residues pruned to eliminate duplicates Z: 8 7.363 1.624 0.496 0.665 0.714 0.571 C 1.376 Z: 16 23.375 1.956 0.641 0.916 1.000 0.667 CB 1.329 16 residues pruned to eliminate duplicates Z: 59 60.089 2.294 1.199 0.592 0.914 0.707 CB 1.568 59 residues pruned to eliminate duplicates Z: 14 18.836 1.856 0.761 0.942 1.000 0.846 CB 1.108 14 residues pruned to eliminate duplicates Z: 9 14.907 2.035 0.313 0.913 1.000 0.750 CB 1.397 9 residues pruned to eliminate duplicates Z: 68 66.023 2.197 1.274 0.631 0.925 0.627 CB 1.544 68 residues pruned to eliminate duplicates Z: 16 53.723 2.330 1.334 0.944 1.000 0.733 CB 1.767 16 residues pruned to eliminate duplicates Z: 15 24.698 1.999 0.834 0.896 1.000 0.643 CB 1.290 14 residues pruned to eliminate duplicates Z: 14 42.005 2.211 1.311 0.943 1.000 0.923 CB 1.580 14 residues pruned to eliminate duplicates Z: 15 38.480 2.136 1.189 0.944 1.000 0.857 CB 1.523 15 residues pruned to eliminate duplicates Z: 13 12.726 2.038 0.682 0.471 0.750 0.667 CB 1.471 13 residues pruned to eliminate duplicates Z: 15 30.248 2.074 1.253 0.912 0.929 0.786 CA 1.320 15 residues pruned to eliminate duplicates Z: 82 66.341 2.123 1.083 0.664 0.938 0.667 CB 1.526 82 residues pruned to eliminate duplicates Z: 9 8.288 1.759 0.157 0.538 1.000 0.625 O 1.387 Z: 17 30.371 1.972 1.090 0.866 1.000 0.688 CB 1.348 17 residues pruned to eliminate duplicates Z: 15 11.231 1.513 0.696 0.770 0.929 0.643 CA 0.991 15 residues pruned to eliminate duplicates Z: 9 3.511 1.734 -0.172 0.438 0.875 0.375 CB 1.053 Z: 85 59.882 2.129 0.992 0.643 0.917 0.583 CB 1.471 85 residues pruned to eliminate duplicates Z: 18 16.889 1.878 0.651 0.538 0.941 0.706 CB 1.352 18 residues pruned to eliminate duplicates Z: 14 17.077 1.870 0.497 0.929 1.000 0.692 CB 1.184 14 residues pruned to eliminate duplicates Z: 9 13.155 2.195 0.453 0.717 0.750 0.250 CA 1.596 9 residues pruned to eliminate duplicates Z: 11 14.634 1.865 0.920 0.699 0.900 0.600 CB 1.197 11 residues pruned to eliminate duplicates Z: 44 27.535 2.073 0.836 0.467 0.884 0.605 CB 1.291 46 residues pruned to eliminate duplicates Z: 17 44.825 2.253 1.350 0.911 1.000 0.688 CB 1.499 17 residues pruned to eliminate duplicates Z: 16 48.787 2.321 1.482 0.932 1.000 0.733 CB 1.527 16 residues pruned to eliminate duplicates Z: 85 74.138 2.216 1.236 0.639 0.929 0.643 CB 1.544 85 residues pruned to eliminate duplicates Z: 16 15.310 2.057 0.798 0.424 0.867 0.533 CB 1.335 16 residues pruned to eliminate duplicates Z: 15 24.773 1.960 0.714 0.923 1.000 0.786 CB 1.385 15 residues pruned to eliminate duplicates Z: 14 23.005 2.145 0.787 0.925 0.923 0.615 CB 1.266 14 residues pruned to eliminate duplicates Z: 14 25.791 2.153 0.906 0.918 0.923 0.538 CB 1.332 14 residues pruned to eliminate duplicates Z: 117 86.101 2.189 1.216 0.651 0.966 0.690 CB 1.482 117 residues pruned to eliminate duplicates Z: 9 16.691 2.123 1.008 0.846 0.875 0.875 CB 1.176 9 residues pruned to eliminate duplicates Z: 26 33.778 2.269 0.822 0.639 0.880 0.720 CB 1.631 26 residues pruned to eliminate duplicates Z: 54 37.008 2.054 0.917 0.565 0.906 0.679 CB 1.339 44 residues pruned to eliminate duplicates Z: 8 8.550 1.784 0.221 0.636 0.857 0.714 CA 1.523 8 residues pruned to eliminate duplicates Z: 16 49.070 2.316 1.368 0.940 1.000 0.867 CB 1.603 16 residues pruned to eliminate duplicates Z: 14 15.997 2.017 0.869 0.429 1.000 0.615 CB 1.267 14 residues pruned to eliminate duplicates Z: 54 58.103 2.283 1.267 0.592 0.887 0.698 CB 1.593 54 residues pruned to eliminate duplicates Z: 11 15.973 2.057 0.266 0.866 1.000 0.800 CB 1.420 11 residues pruned to eliminate duplicates Z: 14 34.115 2.223 1.063 0.878 1.000 0.615 CB 1.497 14 residues pruned to eliminate duplicates Z: 78 48.202 2.080 0.907 0.602 0.935 0.662 CB 1.344 78 residues pruned to eliminate duplicates Z: 38 38.258 2.268 0.896 0.581 0.919 0.649 CB 1.472 38 residues pruned to eliminate duplicates Z: 10 18.831 2.135 0.853 0.815 1.000 0.667 CB 1.207 10 residues pruned to eliminate duplicates Z: 16 34.965 2.094 1.053 0.897 1.000 0.800 CB 1.503 16 residues pruned to eliminate duplicates Z: 15 23.912 1.960 0.700 0.910 1.000 0.571 CB 1.361 15 residues pruned to eliminate duplicates Z: 22 12.887 2.053 0.414 0.409 0.810 0.429 CB 1.316 22 residues pruned to eliminate duplicates Z: 85 69.195 2.208 1.130 0.626 0.929 0.643 CB 1.535 85 residues pruned to eliminate duplicates Z: 21 28.581 2.131 1.252 0.592 0.800 0.400 CB 1.524 21 residues pruned to eliminate duplicates Z: 89 81.474 2.307 1.299 0.596 0.943 0.614 CB 1.584 89 residues pruned to eliminate duplicates Z: 59 55.674 2.235 1.128 0.584 0.914 0.655 CB 1.552 59 residues pruned to eliminate duplicates Z: 16 32.157 2.085 0.929 0.913 1.000 0.867 CA 1.461 16 residues pruned to eliminate duplicates Z: 85 64.746 2.106 1.059 0.647 0.952 0.619 CB 1.492 85 residues pruned to eliminate duplicates Z: 9 22.387 2.242 0.739 0.751 1.000 0.875 CB 1.622 9 residues pruned to eliminate duplicates Z: 7 21.702 2.310 1.033 0.842 0.833 0.667 CA 1.686 7 residues pruned to eliminate duplicates Z: 13 32.136 2.147 1.290 0.920 1.000 0.667 CB 1.329 13 residues pruned to eliminate duplicates Z: 179 86.564 2.208 1.017 0.530 0.927 0.624 CB 1.525 179 residues pruned to eliminate duplicates Z: 11 17.534 1.751 0.934 0.848 1.000 0.700 CB 1.214 11 residues pruned to eliminate duplicates Z: 31 47.010 2.231 1.174 0.622 0.933 0.600 CB 1.689 31 residues pruned to eliminate duplicates Z: 6 4.232 1.785 0.026 0.530 1.000 0.600 CB 1.003 Z: 14 20.293 1.931 0.773 0.847 0.923 0.769 CA 1.322 14 residues pruned to eliminate duplicates Z: 13 35.843 2.196 1.273 0.908 1.000 0.667 CB 1.472 13 residues pruned to eliminate duplicates Z: 16 40.957 2.294 1.321 0.914 0.933 0.333 CB 1.504 16 residues pruned to eliminate duplicates Z: 15 18.311 2.126 0.707 0.458 0.929 0.714 CB 1.517 15 residues pruned to eliminate duplicates Z: 14 14.979 1.876 0.262 0.933 1.000 0.923 CB 1.224 14 residues pruned to eliminate duplicates Z: 16 21.052 1.819 0.494 0.903 1.000 0.800 CA 1.426 16 residues pruned to eliminate duplicates Z: 10 11.520 1.823 0.475 0.865 1.000 0.778 CB 1.046 10 residues pruned to eliminate duplicates Z: 16 44.277 2.266 1.384 0.936 1.000 0.800 CB 1.473 16 residues pruned to eliminate duplicates Z: 61 30.213 2.008 0.722 0.478 0.883 0.533 CB 1.307 63 residues pruned to eliminate duplicates Z: 21 29.816 2.052 1.126 0.721 0.850 0.650 CA 1.473 21 residues pruned to eliminate duplicates Z: 11 12.728 1.732 0.787 0.810 0.900 0.700 CB 1.103 11 residues pruned to eliminate duplicates Z: 108 71.087 2.179 1.073 0.639 0.925 0.626 CB 1.443 108 residues pruned to eliminate duplicates Z: 8 9.743 1.842 0.291 0.880 1.000 1.000 CB 1.121 7 residues pruned to eliminate duplicates Z: 19 17.295 1.841 0.811 0.491 0.944 0.500 CB 1.306 19 residues pruned to eliminate duplicates Z: 17 25.927 1.852 0.909 0.913 0.938 0.750 CA 1.384 17 residues pruned to eliminate duplicates Z: 16 30.132 2.031 1.182 0.927 0.933 0.800 CA 1.318 16 residues pruned to eliminate duplicates Z: 9 17.940 2.178 0.535 0.761 1.000 0.750 CB 1.505 9 residues pruned to eliminate duplicates Z: 68 60.785 2.219 1.111 0.613 0.910 0.657 CB 1.565 68 residues pruned to eliminate duplicates Z: 17 33.222 1.987 1.259 0.926 0.938 0.875 CA 1.384 17 residues pruned to eliminate duplicates Z: 67 58.813 2.149 1.173 0.639 0.955 0.621 CB 1.426 71 residues pruned to eliminate duplicates Z: 128 64.587 2.128 0.928 0.542 0.913 0.614 CB 1.468 128 residues pruned to eliminate duplicates Z: 26 34.493 2.218 1.339 0.562 0.920 0.640 CB 1.361 26 residues pruned to eliminate duplicates Z: 15 23.478 1.965 0.739 0.897 1.000 0.643 CB 1.315 15 residues pruned to eliminate duplicates Z: 36 35.236 2.054 0.807 0.607 0.943 0.686 CB 1.538 36 residues pruned to eliminate duplicates Z: 12 20.550 2.018 0.454 0.909 1.000 0.909 CB 1.498 12 residues pruned to eliminate duplicates Z: 33 41.328 2.195 0.998 0.616 0.969 0.656 CB 1.540 33 residues pruned to eliminate duplicates Z: 16 21.027 1.971 0.944 0.867 0.933 0.600 CB 1.110 16 residues pruned to eliminate duplicates Z: 9 9.136 1.847 0.051 0.797 1.000 0.625 CB 1.283 9 residues pruned to eliminate duplicates Z: 6 8.981 1.817 0.425 0.694 1.000 0.600 CB 1.299 6 residues pruned to eliminate duplicates Z: 39 54.009 2.238 1.208 0.668 0.921 0.605 CB 1.647 39 residues pruned to eliminate duplicates Z: 7 2.954 1.736 0.385 0.247 0.667 0.500 CB 1.007 Z: 9 9.892 1.846 0.645 0.603 0.875 0.625 CB 1.192 8 residues pruned to eliminate duplicates Z: 11 11.543 1.965 0.160 0.894 0.900 0.900 CB 1.277 10 residues pruned to eliminate duplicates Z: 32 42.925 2.148 1.103 0.587 0.968 0.548 CB 1.622 32 residues pruned to eliminate duplicates Z: 17 22.998 1.885 0.590 0.888 1.000 0.750 CB 1.382 17 residues pruned to eliminate duplicates Z: 8 15.161 2.013 0.757 0.807 0.857 0.714 CB 1.446 8 residues pruned to eliminate duplicates Z: 10 7.819 1.816 0.856 0.417 0.778 0.444 CB 1.084 10 residues pruned to eliminate duplicates Z: 16 29.747 1.963 1.088 0.909 1.000 0.667 CA 1.330 16 residues pruned to eliminate duplicates Z: 72 67.416 2.199 1.150 0.663 0.915 0.634 CB 1.589 72 residues pruned to eliminate duplicates Z: 65 62.128 2.166 1.246 0.657 0.969 0.625 CB 1.424 65 residues pruned to eliminate duplicates Z: 64 43.346 2.091 1.007 0.542 0.905 0.540 CB 1.380 64 residues pruned to eliminate duplicates Z: 8 11.078 1.832 0.676 0.886 0.857 0.714 CB 1.149 8 residues pruned to eliminate duplicates Z: 9 12.003 1.840 0.468 0.909 1.000 0.875 CB 1.115 9 residues pruned to eliminate duplicates Z: 17 22.525 1.911 0.916 0.907 0.875 0.562 CA 1.250 17 residues pruned to eliminate duplicates Z: 9 3.028 1.408 0.470 0.209 0.875 0.250 CB 0.835 Z: 10 10.468 1.912 0.287 0.873 0.889 0.778 CB 1.161 10 residues pruned to eliminate duplicates Z: 13 26.827 2.137 0.846 0.935 1.000 1.000 CB 1.368 13 residues pruned to eliminate duplicates Z: 17 33.674 1.998 1.168 0.913 0.938 0.875 CB 1.468 17 residues pruned to eliminate duplicates Z: 6 4.081 1.734 0.769 0.414 0.800 0.600 CB 0.815 6 residues pruned to eliminate duplicates Z: 10 11.781 1.642 0.627 0.814 1.000 0.889 CB 1.119 10 residues pruned to eliminate duplicates Z: 104 76.613 2.169 1.157 0.629 0.942 0.728 CB 1.516 104 residues pruned to eliminate duplicates Z: 18 29.813 2.223 1.174 0.584 0.941 0.765 CB 1.467 14 residues pruned to eliminate duplicates Z: 13 9.949 1.783 0.696 0.314 0.917 0.333 CA 1.273 13 residues pruned to eliminate duplicates Z: 16 24.298 2.016 0.892 0.912 0.933 0.733 CA 1.248 16 residues pruned to eliminate duplicates Z: 17 15.200 2.116 0.714 0.390 0.812 0.500 CB 1.449 17 residues pruned to eliminate duplicates Z: 16 19.716 2.056 1.238 0.438 0.933 0.533 CB 1.264 16 residues pruned to eliminate duplicates Z: 14 19.279 1.936 0.731 0.926 1.000 0.923 CB 1.120 14 residues pruned to eliminate duplicates Z: 6 4.702 1.962 0.714 0.426 0.600 0.400 CB 1.126 6 residues pruned to eliminate duplicates Z: 18 21.403 2.097 1.240 0.402 0.824 0.529 CA 1.489 18 residues pruned to eliminate duplicates Z: 15 27.936 2.042 1.315 0.906 0.929 0.714 CB 1.210 15 residues pruned to eliminate duplicates Z: 165 95.914 2.267 1.078 0.585 0.933 0.646 CB 1.570 165 residues pruned to eliminate duplicates Z: 85 67.899 2.145 1.066 0.669 0.940 0.702 CB 1.520 85 residues pruned to eliminate duplicates Z: 51 24.189 1.960 0.785 0.329 0.840 0.400 CB 1.403 51 residues pruned to eliminate duplicates Z: 12 15.437 1.896 0.414 0.798 1.000 0.727 CA 1.338 12 residues pruned to eliminate duplicates Z: 14 33.998 2.158 1.048 0.936 1.000 1.000 CB 1.486 14 residues pruned to eliminate duplicates Z: 11 12.232 1.854 0.791 0.673 0.800 0.500 CB 1.241 11 residues pruned to eliminate duplicates Z: 16 23.427 1.988 1.135 0.863 0.867 0.600 CB 1.206 16 residues pruned to eliminate duplicates Z: 90 58.888 2.123 1.045 0.586 0.910 0.629 CB 1.455 90 residues pruned to eliminate duplicates Z: 71 54.105 2.217 1.070 0.542 0.871 0.571 CB 1.553 71 residues pruned to eliminate duplicates Z: 11 8.258 1.838 0.237 0.832 0.900 0.800 CB 0.958 10 residues pruned to eliminate duplicates Z: 74 70.303 2.373 1.057 0.600 0.904 0.644 CB 1.694 74 residues pruned to eliminate duplicates Z: 15 32.939 2.082 1.289 0.896 0.929 0.571 CA 1.425 15 residues pruned to eliminate duplicates Z: 11 17.219 1.966 0.983 0.646 0.900 0.700 CB 1.355 Z: 10 10.836 1.817 0.141 0.891 1.000 1.000 CB 1.252 10 residues pruned to eliminate duplicates Z: 6 4.421 1.554 0.043 0.405 1.000 0.400 CB 1.348 Z: 10 8.555 1.798 0.705 0.471 0.778 0.667 CB 1.232 10 residues pruned to eliminate duplicates Z: 126 86.451 2.253 1.163 0.610 0.928 0.600 CB 1.540 126 residues pruned to eliminate duplicates Z: 7 5.571 1.677 0.920 0.686 0.833 0.333 CB 0.715 7 residues pruned to eliminate duplicates Z: 22 25.863 2.021 0.756 0.551 1.000 0.762 CB 1.513 22 residues pruned to eliminate duplicates Z: 14 28.508 2.137 0.883 0.935 1.000 0.923 CB 1.369 14 residues pruned to eliminate duplicates Z: 76 65.703 2.249 1.066 0.582 0.947 0.627 CB 1.595 76 residues pruned to eliminate duplicates Z: 15 24.274 2.013 1.097 0.669 0.929 0.571 CA 1.416 15 residues pruned to eliminate duplicates Z: 132 76.884 2.185 1.080 0.570 0.916 0.649 CB 1.508 132 residues pruned to eliminate duplicates Z: 9 7.691 1.554 0.330 0.734 0.875 0.750 CB 1.219 Z: 12 15.264 2.129 0.411 0.693 0.909 0.273 CB 1.412 12 residues pruned to eliminate duplicates Z: 11 19.277 1.863 0.807 0.828 1.000 0.800 CB 1.363 11 residues pruned to eliminate duplicates Z: 56 61.329 2.341 1.096 0.616 0.945 0.636 CB 1.598 56 residues pruned to eliminate duplicates Z: 67 66.189 2.314 1.155 0.568 0.924 0.652 CB 1.655 67 residues pruned to eliminate duplicates Z: 44 44.502 2.136 1.050 0.651 0.907 0.674 CB 1.485 44 residues pruned to eliminate duplicates Z: 12 18.603 1.958 0.629 0.837 1.000 0.727 CA 1.316 12 residues pruned to eliminate duplicates Z: 14 25.894 2.073 0.919 0.927 1.000 0.923 CA 1.265 14 residues pruned to eliminate duplicates Z: 51 45.148 2.091 0.797 0.690 0.940 0.680 CB 1.519 51 residues pruned to eliminate duplicates Z: 7 2.473 1.567 -0.306 0.517 1.000 0.667 CB 0.914 Z: 11 6.305 1.679 0.079 0.710 1.000 0.700 CB 0.910 11 residues pruned to eliminate duplicates Z: 14 21.118 1.950 0.790 0.903 0.923 0.769 CB 1.295 14 residues pruned to eliminate duplicates Z: 19 28.423 1.993 1.013 0.574 1.000 0.778 CB 1.554 20 residues pruned to eliminate duplicates Z: 11 5.942 1.716 0.590 0.445 0.800 0.600 CB 0.911 Z: 10 7.135 1.886 0.786 0.364 0.667 0.444 CB 1.226 10 residues pruned to eliminate duplicates Z: 9 18.033 1.905 0.733 0.862 1.000 0.875 CA 1.418 9 residues pruned to eliminate duplicates Z: 9 20.522 2.182 1.086 0.894 0.875 0.500 CB 1.307 9 residues pruned to eliminate duplicates Z: 15 43.438 2.113 1.183 0.929 1.000 0.929 CA 1.762 15 residues pruned to eliminate duplicates Z: 7 8.540 1.746 0.529 0.553 0.833 0.667 CB 1.487 7 residues pruned to eliminate duplicates Z: 14 32.526 2.054 1.557 0.907 1.000 0.769 CB 1.221 14 residues pruned to eliminate duplicates Z: 10 12.936 2.117 0.202 0.760 1.000 0.667 CB 1.345 10 residues pruned to eliminate duplicates Z: 32 45.228 2.232 1.258 0.620 0.935 0.581 CB 1.538 32 residues pruned to eliminate duplicates Z: 60 56.379 2.259 1.078 0.609 0.898 0.644 CB 1.569 60 residues pruned to eliminate duplicates Z: 13 33.320 2.332 0.843 0.886 1.000 0.917 CA 1.614 13 residues pruned to eliminate duplicates Z: 10 15.391 2.053 0.967 0.561 0.778 0.667 CB 1.540 10 residues pruned to eliminate duplicates Z: 15 19.029 1.747 0.823 0.875 0.929 0.500 CB 1.251 15 residues pruned to eliminate duplicates Z: 17 21.264 1.875 0.745 0.807 0.938 0.875 CB 1.326 17 residues pruned to eliminate duplicates Z: 11 17.801 2.055 0.579 0.808 0.900 0.800 CA 1.474 11 residues pruned to eliminate duplicates Z: 6 5.319 1.825 -0.013 0.665 0.800 0.800 CB 1.418 Z: 32 53.098 2.305 1.378 0.655 0.935 0.613 CB 1.611 32 residues pruned to eliminate duplicates Z: 9 12.892 1.756 0.648 0.843 1.000 0.750 CB 1.172 9 residues pruned to eliminate duplicates Z: 6 3.511 1.586 -0.147 0.397 1.000 0.600 CB 1.296 Z: 14 25.969 2.097 0.692 0.935 1.000 1.000 CB 1.414 14 residues pruned to eliminate duplicates Z: 11 18.664 1.727 1.132 0.815 1.000 0.300 CB 1.219 11 residues pruned to eliminate duplicates Z: 18 35.397 2.172 1.260 0.611 0.941 0.765 CB 1.672 18 residues pruned to eliminate duplicates Z: 17 31.129 1.935 1.050 0.917 1.000 0.812 CA 1.385 17 residues pruned to eliminate duplicates Z: 8 4.366 1.583 0.100 0.495 1.000 0.286 CB 0.952 Z: 15 28.738 1.902 1.115 0.921 1.000 0.500 CB 1.343 15 residues pruned to eliminate duplicates Z: 16 9.235 2.017 0.608 0.182 0.733 0.267 CA 1.470 16 residues pruned to eliminate duplicates Z: 15 12.980 1.527 0.793 0.719 0.857 0.429 CA 1.212 15 residues pruned to eliminate duplicates Z: 10 13.339 1.822 0.493 0.891 1.000 0.778 CB 1.175 9 residues pruned to eliminate duplicates Z: 11 5.484 1.672 0.033 0.514 0.900 0.600 C 1.100 Z: 10 13.166 1.932 0.539 0.889 0.889 0.778 CB 1.195 11 residues pruned to eliminate duplicates Z: 14 20.175 1.930 0.777 0.919 1.000 0.923 CB 1.150 14 residues pruned to eliminate duplicates Z: 10 10.423 1.934 0.334 0.823 0.889 0.778 CB 1.145 10 residues pruned to eliminate duplicates Z: 7 5.635 1.539 0.422 0.534 0.833 0.833 O 1.219 Z: 11 19.788 2.113 0.743 0.802 1.000 0.800 CA 1.305 11 residues pruned to eliminate duplicates Z: 9 5.526 1.729 0.391 0.523 0.625 0.500 CB 1.271 Z: 15 28.791 2.088 1.108 0.943 1.000 0.786 CB 1.212 15 residues pruned to eliminate duplicates Z: 19 18.512 1.901 0.851 0.499 1.000 0.500 CB 1.241 19 residues pruned to eliminate duplicates Z: 12 9.785 1.785 -0.040 0.911 1.000 0.727 CB 1.220 12 residues pruned to eliminate duplicates Z: 74 66.852 2.191 1.105 0.661 0.945 0.630 CB 1.546 74 residues pruned to eliminate duplicates Z: 12 10.390 1.824 0.524 0.462 0.909 0.727 CA 1.288 12 residues pruned to eliminate duplicates Z: 9 7.157 1.471 0.553 0.867 1.000 0.750 CB 0.811 9 residues pruned to eliminate duplicates Z: 111 76.217 2.174 1.131 0.614 0.936 0.582 CB 1.504 111 residues pruned to eliminate duplicates Z: 33 50.991 2.237 1.209 0.680 0.906 0.688 CA 1.706 33 residues pruned to eliminate duplicates Z: 70 62.682 2.323 1.091 0.569 0.928 0.507 CB 1.566 70 residues pruned to eliminate duplicates Z: 44 49.097 2.283 1.044 0.607 0.930 0.651 CB 1.558 44 residues pruned to eliminate duplicates Z: 8 2.592 1.473 0.523 0.220 0.857 0.286 CB 0.708 Z: 15 33.172 2.180 0.932 0.919 1.000 0.857 CA 1.484 15 residues pruned to eliminate duplicates Z: 10 5.885 1.666 -0.105 0.743 1.000 0.778 CB 1.058 Z: 8 13.530 1.888 0.836 0.925 1.000 1.000 CB 1.036 9 residues pruned to eliminate duplicates Z: 93 73.339 2.196 1.148 0.612 0.957 0.587 CB 1.525 93 residues pruned to eliminate duplicates Z: 79 52.816 2.131 0.964 0.607 0.910 0.538 CB 1.419 79 residues pruned to eliminate duplicates Z: 148 85.683 2.197 1.081 0.575 0.959 0.565 CB 1.498 148 residues pruned to eliminate duplicates Z: 9 15.562 2.034 0.432 0.869 1.000 0.750 CB 1.380 9 residues pruned to eliminate duplicates Z: 14 16.145 1.925 0.529 0.888 1.000 0.769 CB 1.096 14 residues pruned to eliminate duplicates Z: 85 67.092 2.132 1.111 0.665 0.940 0.679 CB 1.484 85 residues pruned to eliminate duplicates Z: 24 15.649 1.794 1.042 0.463 0.826 0.522 CB 1.119 24 residues pruned to eliminate duplicates Z: 8 11.075 1.726 0.525 0.868 1.000 1.000 CB 1.163 8 residues pruned to eliminate duplicates Z: 7 18.137 1.911 0.950 0.873 1.000 0.833 CA 1.447 7 residues pruned to eliminate duplicates Z: 15 28.336 2.042 1.003 0.937 1.000 0.786 CA 1.289 15 residues pruned to eliminate duplicates Z: 63 60.599 2.208 1.216 0.638 0.935 0.710 CB 1.477 63 residues pruned to eliminate duplicates Z: 37 25.667 2.072 1.049 0.478 0.806 0.500 CB 1.280 37 residues pruned to eliminate duplicates Z: 15 18.055 1.759 0.511 0.915 1.000 0.929 CB 1.283 15 residues pruned to eliminate duplicates Z: 10 13.487 1.691 0.818 0.876 1.000 0.889 CB 1.063 9 residues pruned to eliminate duplicates Z: 16 36.606 2.261 1.374 0.905 0.867 0.600 CB 1.446 16 residues pruned to eliminate duplicates Z: 101 65.945 2.132 1.010 0.626 0.920 0.680 CB 1.485 101 residues pruned to eliminate duplicates Z: 84 66.038 2.142 1.072 0.657 0.940 0.687 CB 1.503 84 residues pruned to eliminate duplicates Z: 86 71.341 2.231 1.164 0.613 0.929 0.729 CB 1.550 86 residues pruned to eliminate duplicates Z: 88 69.110 2.245 1.172 0.556 0.908 0.552 CB 1.585 88 residues pruned to eliminate duplicates Z: 22 23.276 2.084 0.902 0.630 0.857 0.571 CB 1.323 22 residues pruned to eliminate duplicates Z: 15 28.291 1.992 0.914 0.911 1.000 0.643 CB 1.405 15 residues pruned to eliminate duplicates Z: 115 87.971 2.195 1.267 0.655 0.974 0.561 CB 1.472 115 residues pruned to eliminate duplicates Z: 88 70.816 2.187 1.165 0.614 0.943 0.655 CB 1.527 88 residues pruned to eliminate duplicates Z: 68 51.014 2.087 0.973 0.577 0.940 0.597 CB 1.495 68 residues pruned to eliminate duplicates Z: 16 31.514 2.000 0.989 0.925 1.000 0.800 CB 1.435 16 residues pruned to eliminate duplicates Z: 14 24.453 2.015 0.621 0.925 1.000 1.000 CB 1.458 14 residues pruned to eliminate duplicates Z: 8 3.226 1.573 0.238 0.601 0.857 0.429 CB 0.664 8 residues pruned to eliminate duplicates Z: 11 17.397 2.160 0.322 0.833 1.000 0.900 CA 1.445 11 residues pruned to eliminate duplicates Z: 14 17.327 1.879 0.793 0.913 1.000 0.769 CB 1.009 14 residues pruned to eliminate duplicates Z: 9 10.180 1.839 0.350 0.824 0.875 0.625 CB 1.251 9 residues pruned to eliminate duplicates Z: 13 8.964 1.840 0.292 0.437 0.917 0.583 CB 1.268 21 residues pruned to eliminate duplicates Z: 16 21.607 2.136 0.862 0.525 0.867 0.600 CB 1.579 21 residues pruned to eliminate duplicates Z: 19 19.817 1.912 0.842 0.532 1.000 0.611 CA 1.285 19 residues pruned to eliminate duplicates Z: 83 70.000 2.211 1.133 0.656 0.927 0.646 CB 1.530 83 residues pruned to eliminate duplicates Z: 85 62.429 2.136 0.977 0.638 0.952 0.679 CB 1.488 85 residues pruned to eliminate duplicates Z: 10 21.898 2.144 0.682 0.915 1.000 0.889 CB 1.431 12 residues pruned to eliminate duplicates Z: 38 42.922 2.158 1.182 0.634 0.892 0.730 CB 1.482 38 residues pruned to eliminate duplicates Z: 12 21.652 2.176 1.097 0.544 0.909 0.455 CB 1.508 12 residues pruned to eliminate duplicates Z: 14 20.718 1.935 0.881 0.922 1.000 0.846 CB 1.110 14 residues pruned to eliminate duplicates Z: 6 5.274 1.742 0.051 0.695 0.800 0.200 CB 1.347 6 residues pruned to eliminate duplicates Z: 35 48.322 2.168 1.284 0.645 1.000 0.529 CB 1.462 35 residues pruned to eliminate duplicates Z: 91 69.825 2.187 1.135 0.601 0.922 0.556 CB 1.552 91 residues pruned to eliminate duplicates Z: 88 64.709 2.138 1.064 0.635 0.920 0.644 CB 1.506 88 residues pruned to eliminate duplicates Z: 14 28.128 2.225 1.041 0.631 0.923 0.615 CA 1.645 14 residues pruned to eliminate duplicates Z: 86 76.172 2.209 1.233 0.627 0.953 0.647 CB 1.560 86 residues pruned to eliminate duplicates Z: 20 48.657 2.468 1.246 0.740 0.947 0.789 CB 1.714 20 residues pruned to eliminate duplicates Z: 13 18.654 2.040 1.094 0.325 1.000 0.583 CA 1.528 13 residues pruned to eliminate duplicates Z: 19 20.689 2.034 0.829 0.498 0.944 0.611 CA 1.390 19 residues pruned to eliminate duplicates Z: 8 2.984 1.619 0.584 0.240 0.571 0.429 N 1.040 Z: 12 13.463 1.647 0.741 0.758 1.000 0.727 CB 1.126 12 residues pruned to eliminate duplicates Z: 9 18.300 1.906 1.075 0.772 1.000 0.625 CB 1.286 9 residues pruned to eliminate duplicates Z: 10 12.857 1.776 0.373 0.834 1.000 0.667 CA 1.317 9 residues pruned to eliminate duplicates Z: 40 47.420 2.216 1.357 0.637 0.872 0.615 CB 1.467 40 residues pruned to eliminate duplicates Z: 13 33.638 2.227 1.214 0.889 0.917 0.750 CA 1.547 13 residues pruned to eliminate duplicates Z: 13 11.389 1.849 0.568 0.394 0.833 0.500 CB 1.523 13 residues pruned to eliminate duplicates Z: 7 5.578 1.490 0.192 0.690 1.000 0.667 N 1.077 Z: 27 33.462 2.154 1.131 0.606 0.923 0.538 CB 1.401 27 residues pruned to eliminate duplicates Z: 10 11.676 1.928 1.053 0.357 0.889 0.667 CB 1.291 10 residues pruned to eliminate duplicates Z: 29 27.314 2.022 0.773 0.626 0.964 0.714 CB 1.326 29 residues pruned to eliminate duplicates Z: 6 4.290 1.497 -0.048 0.646 1.000 0.800 CB 1.175 Z: 78 66.788 2.192 1.111 0.634 0.948 0.610 CB 1.530 78 residues pruned to eliminate duplicates Z: 63 59.657 2.292 1.144 0.572 0.887 0.613 CB 1.621 63 residues pruned to eliminate duplicates Z: 8 3.745 1.456 0.544 0.317 0.714 0.286 CB 1.079 Z: 16 5.147 1.673 0.267 0.242 0.733 0.333 CB 1.152 16 residues pruned to eliminate duplicates Z: 56 63.589 2.203 1.178 0.689 0.964 0.745 CB 1.560 56 residues pruned to eliminate duplicates Z: 11 7.020 1.674 0.394 0.779 0.800 0.600 CB 0.930 11 residues pruned to eliminate duplicates Z: 60 60.375 2.228 1.278 0.610 0.932 0.678 CB 1.497 60 residues pruned to eliminate duplicates Z: 63 43.088 2.172 0.960 0.462 0.903 0.516 CB 1.479 63 residues pruned to eliminate duplicates Z: 86 72.645 2.203 1.149 0.641 0.953 0.659 CB 1.532 86 residues pruned to eliminate duplicates Z: 11 15.856 1.854 0.392 0.863 1.000 0.700 CA 1.426 11 residues pruned to eliminate duplicates Z: 32 50.102 2.235 1.319 0.632 0.935 0.742 CB 1.639 32 residues pruned to eliminate duplicates Z: 15 26.981 2.046 0.821 0.927 1.000 0.643 CB 1.357 15 residues pruned to eliminate duplicates Z: 8 3.834 1.689 0.420 0.500 0.714 0.429 CB 0.846 Z: 8 9.231 1.762 0.598 0.616 0.857 0.714 CB 1.295 8 residues pruned to eliminate duplicates Z: 7 4.392 1.507 0.778 0.315 0.833 0.833 CB 0.985 Z: 15 12.720 1.942 0.633 0.566 0.786 0.643 CB 1.279 15 residues pruned to eliminate duplicates Z: 16 48.585 2.321 1.230 0.937 1.000 0.733 CB 1.687 16 residues pruned to eliminate duplicates Z: 66 54.593 2.176 1.082 0.564 0.954 0.646 CB 1.472 66 residues pruned to eliminate duplicates Z: 23 29.330 2.047 1.004 0.682 0.909 0.727 CB 1.419 23 residues pruned to eliminate duplicates Z: 36 44.783 2.294 1.045 0.578 0.943 0.686 CB 1.588 36 residues pruned to eliminate duplicates Z: 121 75.635 2.150 1.132 0.637 0.917 0.617 CB 1.445 121 residues pruned to eliminate duplicates Z: 14 44.775 2.389 1.441 0.939 0.923 0.769 CB 1.603 14 residues pruned to eliminate duplicates Z: 78 50.977 2.096 0.878 0.601 0.961 0.636 CB 1.395 78 residues pruned to eliminate duplicates Z: 15 27.055 2.190 0.681 0.920 1.000 0.857 CA 1.383 15 residues pruned to eliminate duplicates Z: 6 7.438 1.884 0.415 0.431 1.000 0.400 CA 1.340 7 residues pruned to eliminate duplicates Z: 7 5.675 1.653 0.797 0.544 1.000 0.500 CB 0.747 7 residues pruned to eliminate duplicates Z: 143 88.745 2.227 1.070 0.590 0.951 0.669 CB 1.559 143 residues pruned to eliminate duplicates Z: 57 51.848 2.135 1.037 0.674 0.929 0.643 CB 1.461 57 residues pruned to eliminate duplicates Z: 8 21.180 2.151 0.796 0.797 1.000 0.857 CB 1.598 Z: 16 23.112 1.910 0.631 0.907 1.000 0.733 CA 1.362 16 residues pruned to eliminate duplicates Z: 17 22.856 1.848 1.035 0.890 0.938 0.625 CB 1.166 17 residues pruned to eliminate duplicates Z: 80 79.211 2.285 1.150 0.654 0.975 0.646 CB 1.614 80 residues pruned to eliminate duplicates Z: 13 11.100 1.759 0.322 0.846 0.917 0.833 CA 1.117 13 residues pruned to eliminate duplicates Z: 6 9.153 1.637 0.455 0.873 1.000 0.400 CA 1.251 6 residues pruned to eliminate duplicates Z: 107 70.114 2.169 1.079 0.608 0.934 0.594 CB 1.460 76 residues pruned to eliminate duplicates Z: 10 6.457 1.420 0.800 0.872 0.889 0.667 CB 0.690 Z: 6 8.412 1.860 0.296 0.858 0.800 0.400 CA 1.436 6 residues pruned to eliminate duplicates Z: 39 54.625 2.232 1.320 0.674 0.921 0.579 CB 1.582 39 residues pruned to eliminate duplicates Z: 9 28.594 2.223 1.235 0.920 1.000 0.875 CB 1.434 9 residues pruned to eliminate duplicates Z: 11 17.598 2.075 0.727 0.722 0.900 0.300 CB 1.412 11 residues pruned to eliminate duplicates Z: 8 3.959 1.587 -0.416 0.764 1.000 0.857 CB 1.277 5 residues pruned to eliminate duplicates Z: 9 8.108 1.614 0.488 0.804 0.875 0.500 CB 1.046 9 residues pruned to eliminate duplicates Z: 174 95.346 2.249 1.062 0.576 0.936 0.653 CB 1.552 174 residues pruned to eliminate duplicates Z: 43 34.717 1.964 1.039 0.662 0.905 0.595 CB 1.272 43 residues pruned to eliminate duplicates Z: 35 35.732 2.037 1.063 0.563 0.912 0.647 CB 1.505 35 residues pruned to eliminate duplicates Z: 6 2.429 1.392 -0.097 0.638 1.000 0.800 CB 0.759 Z: 22 21.243 2.167 0.897 0.440 0.810 0.619 CA 1.481 22 residues pruned to eliminate duplicates Z: 10 12.917 2.009 0.595 0.778 0.778 0.667 CA 1.352 10 residues pruned to eliminate duplicates Z: 7 3.581 1.756 -0.036 0.244 0.833 0.500 N 1.392 Z: 20 12.728 1.709 0.518 0.517 0.895 0.526 CB 1.237 9 residues pruned to eliminate duplicates Z: 11 11.989 1.810 0.501 0.875 1.000 0.600 CB 1.015 10 residues pruned to eliminate duplicates Z: 22 18.103 2.094 0.684 0.501 0.857 0.619 CB 1.306 22 residues pruned to eliminate duplicates Z: 17 32.484 1.968 1.018 0.934 1.000 0.812 CB 1.425 17 residues pruned to eliminate duplicates Z: 14 22.477 2.050 0.983 0.810 0.923 0.385 CB 1.268 14 residues pruned to eliminate duplicates Z: 11 11.926 1.933 0.699 0.476 0.900 0.600 CB 1.308 11 residues pruned to eliminate duplicates Z: 10 20.693 2.050 1.396 0.870 0.889 0.667 CB 1.153 10 residues pruned to eliminate duplicates Z: 91 71.806 2.148 1.303 0.647 0.933 0.611 CB 1.430 91 residues pruned to eliminate duplicates Z: 8 4.613 1.724 -0.088 0.553 0.714 0.714 CB 1.475 5 residues pruned to eliminate duplicates Z: 9 4.507 1.692 0.311 0.317 0.750 0.500 CB 1.172 9 residues pruned to eliminate duplicates Z: 12 35.087 2.444 1.135 0.717 1.000 0.818 CA 1.666 12 residues pruned to eliminate duplicates Z: 14 27.835 2.089 1.175 0.923 0.923 0.462 CB 1.294 14 residues pruned to eliminate duplicates Z: 13 34.553 2.213 1.226 0.941 1.000 0.500 CA 1.406 13 residues pruned to eliminate duplicates Z: 69 57.547 2.127 1.042 0.626 0.941 0.706 CB 1.516 69 residues pruned to eliminate duplicates Z: 7 3.643 1.505 0.189 0.543 0.667 0.500 CB 1.196 7 residues pruned to eliminate duplicates Z: 9 5.494 1.399 0.554 0.893 1.000 0.750 CB 0.642 8 residues pruned to eliminate duplicates Z: 17 46.483 2.207 1.533 0.930 0.938 0.688 CB 1.550 17 residues pruned to eliminate duplicates Z: 17 17.838 1.851 0.437 0.859 1.000 0.812 CB 1.234 17 residues pruned to eliminate duplicates Z: 10 7.582 1.559 0.215 0.781 1.000 0.444 CB 1.041 10 residues pruned to eliminate duplicates Z: 76 44.275 2.028 0.916 0.508 0.933 0.600 CB 1.398 76 residues pruned to eliminate duplicates Z: 6 4.185 1.758 0.343 0.830 0.600 0.600 CA 0.994 6 residues pruned to eliminate duplicates Z: 30 40.754 2.211 1.210 0.599 0.897 0.690 CB 1.572 30 residues pruned to eliminate duplicates Z: 103 54.617 2.081 0.927 0.554 0.931 0.696 CB 1.374 103 residues pruned to eliminate duplicates Z: 16 17.964 1.780 0.761 0.860 0.933 0.800 CB 1.165 16 residues pruned to eliminate duplicates Z: 9 7.015 1.810 -0.248 0.855 1.000 1.000 C 1.345 11 residues pruned to eliminate duplicates Z: 10 11.509 1.747 0.419 0.794 1.000 0.667 CA 1.197 10 residues pruned to eliminate duplicates Z: 109 79.085 2.174 1.174 0.640 0.944 0.713 CB 1.495 109 residues pruned to eliminate duplicates Z: 27 24.310 1.929 1.000 0.530 0.923 0.577 CB 1.299 27 residues pruned to eliminate duplicates Z: 15 30.957 2.149 0.787 0.904 1.000 0.929 CA 1.534 15 residues pruned to eliminate duplicates Z: 6 13.189 1.929 0.876 0.828 1.000 1.000 CB 1.227 6 residues pruned to eliminate duplicates Z: 7 6.457 1.743 0.389 0.435 0.833 0.500 CB 1.398 7 residues pruned to eliminate duplicates Z: 7 16.156 2.083 0.797 0.775 1.000 1.000 CB 1.382 7 residues pruned to eliminate duplicates 8 1.555 1.499 0.055 0.195 0.714 0.571 CB 0.748 ? Z: 8 4.620 1.785 0.361 0.427 0.714 0.571 N 1.085 Z: 11 3.709 1.524 0.372 0.452 0.700 0.500 CB 0.842 Z: 121 69.430 2.171 0.970 0.557 0.925 0.608 CB 1.516 121 residues pruned to eliminate duplicates Z: 12 7.746 1.933 0.678 0.246 0.727 0.273 CB 1.326 12 residues pruned to eliminate duplicates Z: 14 31.482 2.105 1.297 0.894 0.923 0.692 CB 1.403 14 residues pruned to eliminate duplicates Z: 6 10.051 1.703 0.926 0.580 1.000 1.000 C 1.270 6 residues pruned to eliminate duplicates Z: 6 3.129 1.699 -0.241 0.436 0.800 0.800 N 1.450 Z: 8 12.823 1.824 0.489 0.866 1.000 0.857 CB 1.306 8 residues pruned to eliminate duplicates Z: 12 35.725 2.340 1.095 0.927 0.909 0.273 CB 1.694 12 residues pruned to eliminate duplicates Z: 8 4.572 1.252 0.375 0.765 0.857 0.571 CB 0.927 Z: 107 75.108 2.171 1.132 0.627 0.934 0.670 CB 1.497 107 residues pruned to eliminate duplicates Z: 13 41.927 2.385 1.230 0.918 0.917 0.667 CA 1.751 13 residues pruned to eliminate duplicates Z: 12 8.672 1.671 0.125 0.703 0.909 0.636 CB 1.272 Z: 39 53.226 2.245 1.282 0.699 0.921 0.684 CB 1.526 39 residues pruned to eliminate duplicates Z: 10 13.153 1.683 0.967 0.762 1.000 0.556 CB 1.050 10 residues pruned to eliminate duplicates Z: 11 5.532 1.584 0.179 0.441 0.900 0.400 CB 1.106 Z: 9 6.951 1.658 0.341 0.385 0.875 0.375 CA 1.427 9 residues pruned to eliminate duplicates Z: 113 62.980 2.213 0.945 0.497 0.893 0.571 CB 1.553 113 residues pruned to eliminate duplicates Z: 51 26.012 2.020 0.647 0.455 0.840 0.580 CB 1.378 51 residues pruned to eliminate duplicates Z: 8 3.094 1.526 -0.183 0.637 0.714 0.571 O 1.155 7 residues pruned to eliminate duplicates Z: 7 6.272 1.810 0.124 0.870 1.000 1.000 CB 0.919 7 residues pruned to eliminate duplicates Z: 11 10.877 1.508 0.692 0.829 1.000 0.900 CA 1.015 11 residues pruned to eliminate duplicates Z: 17 36.132 2.237 1.428 0.914 0.875 0.562 CB 1.344 17 residues pruned to eliminate duplicates Z: 88 64.804 2.147 1.187 0.621 0.920 0.621 CB 1.435 88 residues pruned to eliminate duplicates Z: 83 76.063 2.372 1.166 0.607 0.915 0.683 CB 1.615 83 residues pruned to eliminate duplicates Z: 14 49.904 2.270 1.490 0.921 1.000 0.769 CA 1.723 14 residues pruned to eliminate duplicates Z: 12 37.029 2.380 0.947 0.917 1.000 0.909 CA 1.700 12 residues pruned to eliminate duplicates Z: 14 16.590 1.895 0.586 0.905 1.000 0.769 CB 1.090 14 residues pruned to eliminate duplicates Z: 10 9.151 1.721 0.424 0.789 1.000 0.444 CB 0.966 10 residues pruned to eliminate duplicates Z: 17 14.291 1.856 0.778 0.481 0.875 0.562 CB 1.261 17 residues pruned to eliminate duplicates Z: 28 19.216 1.976 0.917 0.394 0.852 0.630 CB 1.283 28 residues pruned to eliminate duplicates Z: 6 3.070 1.530 0.458 0.595 0.600 0.600 CB 0.936 Z: 16 25.234 1.959 1.101 0.904 0.933 0.667 CA 1.208 16 residues pruned to eliminate duplicates Z: 10 6.502 1.532 0.145 0.841 1.000 0.556 CB 0.922 10 residues pruned to eliminate duplicates Z: 6 4.909 1.666 0.236 0.419 1.000 0.600 CA 1.160 4 residues pruned to eliminate duplicates Z: 34 27.088 2.015 1.036 0.412 0.909 0.606 CB 1.387 34 residues pruned to eliminate duplicates 6 0.350 1.424 0.376 0.299 0.600 0.400 CB 0.167 ? Z: 57 45.387 2.157 1.074 0.515 0.911 0.518 CB 1.467 41 residues pruned to eliminate duplicates Z: 84 75.282 2.236 1.241 0.640 0.940 0.639 CB 1.540 84 residues pruned to eliminate duplicates Z: 9 5.310 1.352 0.445 0.864 1.000 1.000 CB 0.704 9 residues pruned to eliminate duplicates Z: 6 9.144 1.757 0.732 0.652 1.000 0.800 CB 1.167 Z: 10 12.812 1.831 0.578 0.910 1.000 0.778 CB 1.049 10 residues pruned to eliminate duplicates Z: 10 8.323 1.819 0.285 0.629 1.000 0.667 CB 1.052 10 residues pruned to eliminate duplicates Z: 7 5.590 1.904 0.439 0.250 0.667 0.500 CB 1.666 7 residues pruned to eliminate duplicates Z: 33 38.881 2.162 1.242 0.587 0.906 0.594 CB 1.440 33 residues pruned to eliminate duplicates Z: 7 9.197 1.840 0.136 0.887 1.000 1.000 CB 1.295 7 residues pruned to eliminate duplicates Z: 8 28.133 2.196 1.228 0.917 1.000 1.000 CB 1.534 8 residues pruned to eliminate duplicates Z: 10 11.074 1.555 0.626 0.770 1.000 0.667 CA 1.150 10 residues pruned to eliminate duplicates Z: 66 46.004 2.070 0.913 0.554 0.938 0.631 CB 1.457 66 residues pruned to eliminate duplicates Z: 7 3.827 1.612 0.484 0.399 0.667 0.167 CA 1.091 Z: 7 5.854 1.710 -0.030 0.797 1.000 0.833 CB 1.111 6 residues pruned to eliminate duplicates Z: 9 7.875 1.815 0.393 0.495 0.875 0.500 C 1.266 9 residues pruned to eliminate duplicates Z: 16 13.832 2.028 0.875 0.480 0.800 0.533 CB 1.198 16 residues pruned to eliminate duplicates Z: 66 56.208 2.254 1.078 0.516 0.938 0.662 CB 1.562 66 residues pruned to eliminate duplicates Z: 16 13.647 1.819 0.506 0.581 1.000 0.467 CB 1.189 16 residues pruned to eliminate duplicates Z: 12 48.812 2.514 1.443 0.928 0.909 0.364 CB 1.846 12 residues pruned to eliminate duplicates Z: 26 36.079 2.209 0.976 0.614 0.960 0.600 CB 1.546 26 residues pruned to eliminate duplicates Z: 13 13.620 1.843 1.058 0.428 0.833 0.500 CB 1.340 Z: 8 5.649 1.517 0.444 0.717 1.000 0.571 CB 0.801 8 residues pruned to eliminate duplicates Z: 9 14.300 1.844 0.561 0.878 1.000 0.875 CB 1.274 9 residues pruned to eliminate duplicates Z: 32 36.999 2.146 1.042 0.558 0.903 0.710 CB 1.587 32 residues pruned to eliminate duplicates Z: 10 7.168 1.462 0.463 0.756 0.778 0.333 CA 1.144 10 residues pruned to eliminate duplicates Z: 101 75.356 2.179 1.140 0.628 0.940 0.620 CB 1.524 101 residues pruned to eliminate duplicates Z: 113 82.582 2.239 1.164 0.614 0.929 0.679 CB 1.557 113 residues pruned to eliminate duplicates Z: 36 35.403 1.983 1.110 0.634 0.943 0.629 CB 1.337 36 residues pruned to eliminate duplicates Z: 47 58.296 2.259 1.164 0.631 0.935 0.587 CB 1.663 47 residues pruned to eliminate duplicates Z: 7 23.148 2.328 0.854 0.863 1.000 0.833 CB 1.607 7 residues pruned to eliminate duplicates Z: 11 8.160 2.037 0.478 0.515 0.800 0.500 CB 1.055 11 residues pruned to eliminate duplicates Z: 9 6.615 1.475 0.563 0.821 0.875 0.625 CB 0.877 9 residues pruned to eliminate duplicates Z: 6 3.762 1.809 0.838 0.617 0.800 0.400 N 0.566 Z: 11 12.507 1.927 0.478 0.460 1.000 0.600 CB 1.446 11 residues pruned to eliminate duplicates Z: 7 7.515 1.647 0.187 0.835 1.000 1.000 CB 1.176 7 residues pruned to eliminate duplicates Z: 7 10.617 1.928 0.405 0.811 0.833 0.667 CB 1.464 7 residues pruned to eliminate duplicates Z: 18 17.690 2.055 0.971 0.497 0.765 0.471 CB 1.389 18 residues pruned to eliminate duplicates Z: 7 2.601 1.491 0.102 0.395 0.833 0.500 CB 0.866 7 residues pruned to eliminate duplicates Z: 11 14.048 1.963 1.144 0.406 0.900 0.600 CB 1.294 11 residues pruned to eliminate duplicates Z: 17 30.785 2.106 0.893 0.891 0.938 0.812 CB 1.480 17 residues pruned to eliminate duplicates Z: 68 47.246 2.037 0.922 0.628 0.881 0.642 CB 1.484 68 residues pruned to eliminate duplicates 6 1.854 1.472 0.599 0.327 0.600 0.400 N 0.710 ? Z: 38 39.246 2.163 0.994 0.538 0.919 0.486 CA 1.568 38 residues pruned to eliminate duplicates Z: 8 5.767 1.813 -0.205 0.918 1.000 1.000 CB 1.067 8 residues pruned to eliminate duplicates Z: 10 14.287 1.686 1.032 0.755 0.889 0.667 CB 1.246 10 residues pruned to eliminate duplicates Z: 45 39.443 1.974 1.118 0.644 0.886 0.682 CB 1.403 45 residues pruned to eliminate duplicates Z: 120 92.897 2.278 1.201 0.634 0.950 0.613 CB 1.577 120 residues pruned to eliminate duplicates Z: 10 14.259 1.890 0.471 0.635 1.000 0.667 CA 1.506 10 residues pruned to eliminate duplicates Z: 15 22.251 2.008 0.665 0.602 1.000 0.714 CB 1.614 15 residues pruned to eliminate duplicates Z: 16 14.366 1.976 0.989 0.319 0.800 0.533 CA 1.440 16 residues pruned to eliminate duplicates Z: 64 43.762 2.090 0.952 0.570 0.873 0.524 CB 1.447 64 residues pruned to eliminate duplicates Z: 6 3.820 1.549 0.679 0.604 0.800 0.600 CB 0.744 Z: 10 16.396 1.874 0.902 0.885 0.889 0.667 CA 1.246 10 residues pruned to eliminate duplicates Z: 15 10.992 1.948 0.792 0.263 0.786 0.429 CA 1.404 15 residues pruned to eliminate duplicates Z: 18 30.885 1.962 1.107 0.847 1.000 0.471 CB 1.345 18 residues pruned to eliminate duplicates Z: 7 3.913 1.715 0.092 0.431 0.667 0.333 O 1.375 7 residues pruned to eliminate duplicates Z: 111 75.437 2.242 1.112 0.559 0.918 0.664 CB 1.562 111 residues pruned to eliminate duplicates Z: 8 7.626 1.681 0.575 0.752 0.857 0.571 CB 1.015 8 residues pruned to eliminate duplicates Z: 21 7.076 1.448 0.199 0.546 0.950 0.650 CB 0.917 9 residues pruned to eliminate duplicates Z: 7 10.639 1.662 1.086 0.712 1.000 0.667 N 1.034 Z: 114 92.828 2.285 1.200 0.642 0.947 0.664 CB 1.606 114 residues pruned to eliminate duplicates Z: 82 73.930 2.181 1.214 0.641 0.938 0.691 CB 1.590 82 residues pruned to eliminate duplicates Z: 113 74.920 2.291 1.131 0.536 0.893 0.688 CB 1.568 113 residues pruned to eliminate duplicates Z: 20 8.754 1.549 0.334 0.425 0.947 0.632 CB 1.110 15 residues pruned to eliminate duplicates Z: 11 19.480 1.979 0.847 0.771 1.000 0.600 CB 1.326 9 residues pruned to eliminate duplicates Z: 6 4.284 1.280 0.589 0.643 1.000 0.400 CA 0.824 Z: 6 3.362 1.648 0.122 0.539 1.000 1.000 CB 0.783 6 residues pruned to eliminate duplicates Z: 6 2.010 0.947 0.828 0.716 0.600 0.200 CA 0.712 Z: 6 5.376 1.916 -0.320 0.771 1.000 0.800 N 1.451 7 residues pruned to eliminate duplicates Z: 7 10.147 1.762 0.467 0.885 1.000 1.000 CB 1.157 7 residues pruned to eliminate duplicates Z: 8 6.554 1.762 -0.093 0.731 1.000 0.571 CB 1.259 9 residues pruned to eliminate duplicates Z: 43 41.193 2.062 1.050 0.639 0.905 0.738 CB 1.459 43 residues pruned to eliminate duplicates Z: 43 42.664 2.167 1.041 0.533 0.905 0.619 CB 1.592 43 residues pruned to eliminate duplicates Z: 21 42.602 2.419 1.388 0.675 0.900 0.700 CB 1.560 21 residues pruned to eliminate duplicates Z: 85 73.161 2.324 1.113 0.611 0.905 0.583 CB 1.618 85 residues pruned to eliminate duplicates Z: 20 11.631 1.735 0.638 0.300 0.895 0.368 CB 1.313 20 residues pruned to eliminate duplicates Z: 9 3.398 1.452 0.055 0.491 0.875 0.250 CB 0.905 Z: 15 8.861 1.696 0.702 0.256 0.857 0.571 CA 1.265 15 residues pruned to eliminate duplicates Z: 32 13.150 1.696 0.573 0.346 0.903 0.548 CB 1.159 32 residues pruned to eliminate duplicates Z: 32 25.562 2.024 0.539 0.551 0.935 0.613 CB 1.499 32 residues pruned to eliminate duplicates Z: 8 5.090 1.593 0.171 0.360 1.000 0.714 CB 1.199 Z: 8 10.997 1.759 0.443 0.713 1.000 0.714 CB 1.350 8 residues pruned to eliminate duplicates Z: 68 52.640 2.102 0.973 0.577 0.925 0.537 CB 1.556 68 residues pruned to eliminate duplicates Z: 14 23.186 2.086 0.890 0.612 0.923 0.692 CA 1.589 14 residues pruned to eliminate duplicates Z: 10 5.875 1.556 0.195 0.765 0.889 0.556 CB 0.937 10 residues pruned to eliminate duplicates Z: 14 16.229 1.901 0.467 0.823 0.923 0.462 CB 1.322 14 residues pruned to eliminate duplicates Z: 6 2.849 1.428 0.073 0.679 0.800 0.800 CB 0.881 6 residues pruned to eliminate duplicates Z: 7 7.874 1.767 0.262 0.690 0.833 0.667 N 1.454 7 residues pruned to eliminate duplicates Z: 22 22.578 2.054 0.776 0.432 0.905 0.619 CB 1.603 22 residues pruned to eliminate duplicates Z: 10 19.488 2.001 1.111 0.925 1.000 0.667 CB 1.079 10 residues pruned to eliminate duplicates Z: 56 52.227 2.173 1.254 0.614 0.909 0.636 CB 1.420 56 residues pruned to eliminate duplicates Z: 10 5.236 1.546 0.305 0.639 1.000 0.778 CB 0.760 Z: 17 8.456 1.610 0.629 0.328 0.750 0.500 CB 1.299 9 residues pruned to eliminate duplicates Z: 11 12.102 1.881 0.312 0.716 1.000 0.700 CA 1.275 11 residues pruned to eliminate duplicates Z: 7 12.577 1.922 0.998 0.739 1.000 0.833 CB 1.079 7 residues pruned to eliminate duplicates Z: 11 10.676 1.646 0.357 0.780 1.000 0.700 CB 1.181 11 residues pruned to eliminate duplicates Z: 26 33.853 2.199 0.883 0.568 1.000 0.600 CA 1.531 26 residues pruned to eliminate duplicates Z: 7 3.174 1.521 0.297 0.356 0.667 0.333 CA 1.150 7 residues pruned to eliminate duplicates Z: 9 8.119 1.853 0.600 0.227 0.875 0.625 CB 1.523 9 residues pruned to eliminate duplicates Z: 15 4.943 1.616 0.171 0.454 0.714 0.429 CB 1.024 15 residues pruned to eliminate duplicates Z: 8 19.328 2.048 1.223 0.774 1.000 0.714 CB 1.259 8 residues pruned to eliminate duplicates Z: 13 33.787 2.358 0.840 0.904 1.000 0.917 CA 1.602 13 residues pruned to eliminate duplicates Z: 25 37.981 2.226 1.116 0.604 0.958 0.667 CB 1.557 25 residues pruned to eliminate duplicates Z: 12 4.115 1.428 0.404 0.443 0.818 0.455 N 0.802 Z: 14 21.337 1.841 1.043 0.932 1.000 0.692 CB 1.099 14 residues pruned to eliminate duplicates Z: 43 46.163 2.160 1.099 0.642 0.905 0.548 CB 1.521 43 residues pruned to eliminate duplicates Z: 7 9.963 1.757 0.977 0.715 1.000 0.833 CB 0.964 Z: 11 13.559 2.008 1.063 0.490 0.900 0.600 CB 1.161 11 residues pruned to eliminate duplicates Z: 6 2.525 1.397 1.055 0.368 0.600 0.200 CB 0.755 Z: 114 71.049 2.148 1.103 0.582 0.876 0.593 CB 1.561 213 residues pruned to eliminate duplicates Z: 56 50.979 2.129 1.057 0.603 0.982 0.582 CB 1.450 56 residues pruned to eliminate duplicates Z: 10 7.732 1.545 0.232 0.707 1.000 0.667 CB 1.122 5 residues pruned to eliminate duplicates Z: 27 18.452 1.893 0.853 0.438 0.923 0.692 CB 1.191 27 residues pruned to eliminate duplicates Z: 112 73.496 2.153 1.158 0.649 0.910 0.694 CB 1.436 112 residues pruned to eliminate duplicates Z: 15 32.922 2.096 1.098 0.935 1.000 0.857 CA 1.395 15 residues pruned to eliminate duplicates Z: 7 9.482 2.061 0.547 0.443 1.000 0.500 CA 1.288 7 residues pruned to eliminate duplicates Z: 18 15.689 1.883 0.594 0.349 0.941 0.529 CA 1.587 18 residues pruned to eliminate duplicates Z: 8 2.534 1.409 -0.143 0.477 1.000 0.857 CA 0.812 Z: 31 25.488 1.972 0.834 0.484 0.900 0.567 CB 1.453 31 residues pruned to eliminate duplicates Z: 25 19.577 1.977 0.751 0.486 0.875 0.500 CA 1.337 58 residues pruned to eliminate duplicates Z: 9 8.830 1.773 0.064 0.748 1.000 0.500 CB 1.326 9 residues pruned to eliminate duplicates Z: 7 6.598 1.744 0.133 0.748 1.000 0.833 CB 1.092 9 residues pruned to eliminate duplicates Z: 10 4.199 1.595 0.656 0.393 0.667 0.556 N 0.891 Z: 58 44.288 1.990 1.178 0.678 0.895 0.632 CB 1.284 58 residues pruned to eliminate duplicates Z: 68 70.654 2.257 1.182 0.668 0.940 0.701 CB 1.597 68 residues pruned to eliminate duplicates Z: 12 27.496 2.274 1.146 0.614 0.909 0.545 CA 1.678 12 residues pruned to eliminate duplicates Z: 10 5.986 1.546 0.522 0.520 0.889 0.667 CB 0.935 16 residues pruned to eliminate duplicates Z: 23 22.377 2.111 0.792 0.513 0.955 0.682 CB 1.305 23 residues pruned to eliminate duplicates Z: 21 14.612 1.877 0.647 0.477 0.900 0.650 CB 1.201 21 residues pruned to eliminate duplicates Z: 8 7.061 1.805 0.520 0.417 1.000 0.714 CB 1.060 5 residues pruned to eliminate duplicates Z: 58 54.326 2.207 1.118 0.590 0.912 0.614 CB 1.548 Z: 9 5.024 1.402 0.272 0.584 0.875 0.750 CB 1.051 9 residues pruned to eliminate duplicates Z: 103 80.451 2.169 1.139 0.644 0.961 0.618 CB 1.562 161 residues pruned to eliminate duplicates Z: 50 61.066 2.412 1.142 0.611 0.918 0.633 CB 1.655 50 residues pruned to eliminate duplicates Z: 12 17.138 1.887 0.914 0.711 0.909 0.818 CB 1.300 12 residues pruned to eliminate duplicates Z: 16 46.372 2.307 1.521 0.929 1.000 0.800 CB 1.440 16 residues pruned to eliminate duplicates Z: 54 66.477 2.332 1.336 0.631 0.943 0.679 CB 1.571 54 residues pruned to eliminate duplicates Z: 10 18.174 2.120 0.645 0.857 0.889 0.667 CB 1.440 10 residues pruned to eliminate duplicates Z: 12 25.301 2.343 0.740 0.892 0.909 0.818 CA 1.479 12 residues pruned to eliminate duplicates Z: 137 78.882 2.148 1.089 0.614 0.926 0.618 CB 1.460 137 residues pruned to eliminate duplicates Z: 9 17.343 1.924 0.991 0.621 1.000 0.875 CB 1.427 23 residues pruned to eliminate duplicates Z: 11 13.946 1.990 0.785 0.539 0.900 0.500 CB 1.328 11 residues pruned to eliminate duplicates Z: 8 14.880 1.967 1.030 0.835 0.714 0.429 CA 1.477 8 residues pruned to eliminate duplicates Z: 11 10.944 1.838 0.622 0.552 0.800 0.700 CB 1.379 11 residues pruned to eliminate duplicates Z: 45 46.110 2.032 0.991 0.675 0.977 0.750 CA 1.496 45 residues pruned to eliminate duplicates Z: 42 32.021 2.109 0.843 0.498 0.927 0.659 CB 1.391 42 residues pruned to eliminate duplicates Z: 13 21.611 1.999 1.215 0.573 0.917 0.583 CB 1.433 11 residues pruned to eliminate duplicates Z: 87 63.922 2.281 1.087 0.534 0.919 0.593 CB 1.525 87 residues pruned to eliminate duplicates Z: 14 29.634 2.092 1.049 0.902 0.923 0.846 CB 1.482 14 residues pruned to eliminate duplicates Z: 18 32.315 2.025 1.219 0.826 1.000 0.647 CB 1.316 18 residues pruned to eliminate duplicates Z: 85 61.875 2.120 1.099 0.622 0.940 0.643 CB 1.438 85 residues pruned to eliminate duplicates Z: 22 27.094 2.165 0.919 0.458 0.905 0.571 CA 1.642 22 residues pruned to eliminate duplicates Z: 38 35.217 2.102 0.956 0.532 0.946 0.595 CB 1.443 38 residues pruned to eliminate duplicates Z: 11 16.953 1.991 0.655 0.568 1.000 0.600 CA 1.523 Z: 14 21.436 1.921 0.818 0.910 1.000 0.769 CB 1.207 14 residues pruned to eliminate duplicates Z: 7 3.089 1.446 0.297 0.455 1.000 0.667 CB 0.704 7 residues pruned to eliminate duplicates Z: 6 2.549 1.034 0.294 0.747 1.000 0.800 N 0.683 Z: 27 24.821 2.186 0.683 0.498 0.923 0.692 CB 1.437 27 residues pruned to eliminate duplicates Z: 23 29.979 2.036 1.064 0.604 0.909 0.682 CA 1.515 23 residues pruned to eliminate duplicates Z: 70 54.974 2.146 0.986 0.623 0.942 0.623 CB 1.468 70 residues pruned to eliminate duplicates Z: 24 14.442 1.855 0.594 0.332 0.913 0.609 CB 1.340 24 residues pruned to eliminate duplicates Z: 16 13.142 1.966 0.749 0.415 0.933 0.733 CB 1.156 16 residues pruned to eliminate duplicates Z: 6 5.017 1.835 -0.334 0.829 1.000 0.800 C 1.382 6 residues pruned to eliminate duplicates Z: 8 12.225 1.882 0.538 0.810 1.000 0.286 CB 1.218 8 residues pruned to eliminate duplicates Z: 33 43.372 2.287 1.144 0.569 0.906 0.656 CB 1.614 33 residues pruned to eliminate duplicates Z: 39 34.609 2.111 1.081 0.489 0.868 0.447 CA 1.488 39 residues pruned to eliminate duplicates Z: 84 70.567 2.210 1.069 0.650 0.964 0.723 CB 1.527 84 residues pruned to eliminate duplicates Z: 8 7.387 1.640 0.779 0.500 1.000 0.571 CB 0.956 Z: 32 36.883 2.185 0.984 0.585 0.935 0.645 CA 1.505 32 residues pruned to eliminate duplicates Z: 14 28.144 2.042 0.965 0.939 1.000 0.923 CA 1.352 14 residues pruned to eliminate duplicates Z: 16 19.093 1.997 0.637 0.554 1.000 0.600 CA 1.432 16 residues pruned to eliminate duplicates Z: 21 7.878 1.778 0.596 0.277 0.700 0.500 CB 1.142 21 residues pruned to eliminate duplicates Z: 80 39.376 2.014 0.823 0.507 0.899 0.633 CB 1.333 80 residues pruned to eliminate duplicates Z: 7 3.808 1.538 0.081 0.604 0.833 0.500 CB 1.017 Z: 26 16.555 1.869 0.490 0.599 0.920 0.600 CB 1.176 Z: 68 66.372 2.334 1.170 0.617 0.925 0.627 CB 1.549 68 residues pruned to eliminate duplicates Z: 8 7.103 1.949 0.420 0.406 0.714 0.429 CA 1.498 Z: 7 2.431 0.978 0.628 0.583 0.833 0.667 CB 0.691 Z: 16 14.419 2.018 0.745 0.352 0.867 0.667 CB 1.432 16 residues pruned to eliminate duplicates Z: 85 60.931 2.272 1.043 0.529 0.893 0.619 CB 1.559 85 residues pruned to eliminate duplicates Z: 114 78.579 2.179 1.132 0.618 0.920 0.681 CB 1.546 114 residues pruned to eliminate duplicates Z: 86 65.768 2.123 1.064 0.666 0.941 0.600 CB 1.483 86 residues pruned to eliminate duplicates Z: 43 45.722 2.244 1.058 0.607 0.905 0.571 CB 1.526 43 residues pruned to eliminate duplicates Z: 17 44.443 2.193 1.314 0.926 0.938 0.312 CB 1.638 17 residues pruned to eliminate duplicates Z: 6 2.332 1.460 0.530 0.293 0.600 0.600 CB 0.982 Z: 41 21.241 1.827 0.531 0.491 0.975 0.625 CB 1.242 24 residues pruned to eliminate duplicates Z: 8 10.271 1.773 0.990 0.732 0.714 0.429 CA 1.250 8 residues pruned to eliminate duplicates Z: 28 33.837 2.175 0.948 0.600 0.926 0.741 CB 1.509 28 residues pruned to eliminate duplicates Z: 6 3.614 1.104 0.664 0.766 1.000 1.000 CA 0.694 Z: 12 9.628 1.689 0.631 0.608 0.818 0.455 CB 1.163 12 residues pruned to eliminate duplicates Z: 6 3.399 1.711 0.074 0.567 0.800 0.400 CB 0.969 6 residues pruned to eliminate duplicates Z: 137 77.544 2.102 1.131 0.573 0.926 0.574 CB 1.492 137 residues pruned to eliminate duplicates 810 residues left after pruning, divided into chains as follows: A: 9 B: 178 C: 10 D: 10 E: 13 F: 19 G: 10 H: 94 I: 121 J: 109 K: 120 L: 64 M: 10 N: 43 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 36.67 % ------------------------------------------------------------------------------ Global autotracing cycle 2 = 0.300, Contrast = 0.488, Connect. = 0.735 for dens.mod. cycle 1 = 0.300, Contrast = 0.565, Connect. = 0.760 for dens.mod. cycle 2 = 0.300, Contrast = 0.674, Connect. = 0.789 for dens.mod. cycle 3 = 0.300, Contrast = 0.681, Connect. = 0.790 for dens.mod. cycle 4 = 0.300, Contrast = 0.693, Connect. = 0.792 for dens.mod. cycle 5 = 0.300, Contrast = 0.697, Connect. = 0.793 for dens.mod. cycle 6 = 0.300, Contrast = 0.703, Connect. = 0.794 for dens.mod. cycle 7 = 0.300, Contrast = 0.705, Connect. = 0.795 for dens.mod. cycle 8 = 0.300, Contrast = 0.708, Connect. = 0.796 for dens.mod. cycle 9 = 0.300, Contrast = 0.709, Connect. = 0.796 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 6394 peaks > 0.5 sigma used to seed fragment search Space for about 1274 unique residues taking solvent into account 1308 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 17 35.835 2.321 0.721 0.942 1.000 0.812 CB 1.555 B: 13 39.809 2.443 1.052 0.870 1.000 0.750 CB 1.673 C: 13 42.910 2.465 1.221 0.894 0.917 0.833 CA 1.770 D: 14 47.135 2.367 1.092 0.893 1.000 0.769 CB 1.895 13 residues pruned to eliminate duplicates E: 15 51.175 2.408 1.278 0.940 1.000 0.714 CB 1.731 15 residues pruned to eliminate duplicates F: 13 49.650 2.531 0.980 0.918 1.000 0.750 CB 2.016 14 residues pruned to eliminate duplicates G: 15 38.393 2.401 0.844 0.921 1.000 0.786 CB 1.631 H: 15 26.157 2.219 0.648 0.855 0.929 0.714 CB 1.519 15 residues pruned to eliminate duplicates I: 14 40.657 2.328 1.195 0.896 1.000 0.846 CA 1.581 13 residues pruned to eliminate duplicates J: 12 42.752 2.433 1.189 0.907 1.000 0.909 CA 1.720 12 residues pruned to eliminate duplicates K: 12 42.163 2.616 0.972 0.911 0.909 0.909 CB 1.921 12 residues pruned to eliminate duplicates L: 61 62.802 2.328 0.977 0.594 0.933 0.633 CB 1.725 M: 15 48.125 2.216 1.376 0.913 1.000 0.786 CA 1.729 N: 13 37.543 2.390 1.043 0.883 0.917 0.583 CA 1.750 13 residues pruned to eliminate duplicates O: 17 44.764 2.297 1.037 0.918 1.000 0.688 CB 1.687 17 residues pruned to eliminate duplicates P: 17 38.888 2.257 0.990 0.931 0.938 0.875 CB 1.613 15 residues pruned to eliminate duplicates Q: 16 25.068 2.166 0.606 0.903 0.933 0.667 CA 1.422 R: 67 69.011 2.311 1.040 0.657 0.955 0.576 CB 1.631 S: 13 41.755 2.499 0.810 0.902 1.000 0.833 CA 1.901 13 residues pruned to eliminate duplicates T: 17 38.163 2.328 0.923 0.937 0.938 0.875 CB 1.582 17 residues pruned to eliminate duplicates U: 15 32.749 2.401 1.139 0.592 0.929 0.714 CA 1.682 15 residues pruned to eliminate duplicates V: 16 29.510 2.335 0.811 0.792 0.933 0.600 CA 1.494 14 residues pruned to eliminate duplicates W: 15 27.158 2.217 0.602 0.901 0.929 0.786 CB 1.570 15 residues pruned to eliminate duplicates X: 14 34.818 2.368 0.753 0.913 1.000 0.923 CB 1.646 14 residues pruned to eliminate duplicates Y: 12 45.900 2.483 1.046 0.923 1.000 0.909 CB 1.914 13 residues pruned to eliminate duplicates Z: 11 18.528 2.286 0.157 0.833 1.000 0.900 CA 1.663 Z: 109 79.400 2.333 0.985 0.573 0.917 0.611 CB 1.678 90 residues pruned to eliminate duplicates Z: 66 54.340 2.342 0.898 0.535 0.892 0.600 CB 1.641 62 residues pruned to eliminate duplicates Z: 84 76.146 2.310 1.029 0.619 0.952 0.590 CB 1.675 15 residues pruned to eliminate duplicates Z: 15 45.535 2.246 1.111 0.894 1.000 0.714 CB 1.842 15 residues pruned to eliminate duplicates Z: 12 51.376 2.592 1.505 0.912 0.909 0.818 CA 1.858 13 residues pruned to eliminate duplicates Z: 12 46.768 2.628 0.858 0.916 1.000 0.909 CB 2.040 12 residues pruned to eliminate duplicates Z: 14 34.349 2.320 0.617 0.922 1.000 0.846 CA 1.785 14 residues pruned to eliminate duplicates Z: 14 37.424 2.362 1.043 0.931 0.923 0.538 CA 1.629 14 residues pruned to eliminate duplicates Z: 13 32.406 2.382 0.959 0.845 0.833 0.833 CA 1.789 13 residues pruned to eliminate duplicates Z: 12 45.237 2.577 1.171 0.921 0.909 0.909 CA 1.888 12 residues pruned to eliminate duplicates Z: 124 82.461 2.352 0.953 0.585 0.902 0.626 CB 1.654 80 residues pruned to eliminate duplicates Z: 16 41.440 2.362 1.069 0.905 0.867 0.733 CB 1.797 16 residues pruned to eliminate duplicates Z: 14 31.240 2.187 1.075 0.912 0.846 0.692 CB 1.599 14 residues pruned to eliminate duplicates Z: 10 22.033 2.130 0.985 0.723 1.000 0.556 CA 1.420 Z: 15 40.257 2.192 1.238 0.860 1.000 0.786 CA 1.613 15 residues pruned to eliminate duplicates Z: 14 41.124 2.330 0.978 0.884 1.000 0.692 CA 1.788 14 residues pruned to eliminate duplicates Z: 117 77.468 2.316 0.940 0.567 0.914 0.595 CB 1.643 73 residues pruned to eliminate duplicates Z: 16 47.102 2.330 1.069 0.941 1.000 1.000 CA 1.751 16 residues pruned to eliminate duplicates Z: 14 35.359 2.357 1.075 0.911 0.923 0.923 CB 1.540 14 residues pruned to eliminate duplicates Z: 39 53.096 2.321 1.237 0.644 0.868 0.500 CB 1.670 39 residues pruned to eliminate duplicates Z: 14 37.993 2.348 0.937 0.931 1.000 0.615 CB 1.619 14 residues pruned to eliminate duplicates Z: 14 25.634 1.978 0.816 0.911 1.000 1.000 CA 1.402 Z: 17 44.354 2.321 1.098 0.920 1.000 0.688 CB 1.604 17 residues pruned to eliminate duplicates Z: 16 40.774 2.395 0.895 0.926 1.000 0.867 CB 1.627 16 residues pruned to eliminate duplicates Z: 83 71.052 2.275 0.945 0.646 0.927 0.720 CB 1.670 72 residues pruned to eliminate duplicates Z: 18 41.905 2.298 1.122 0.919 0.941 0.765 CB 1.560 18 residues pruned to eliminate duplicates Z: 74 58.863 2.230 1.002 0.646 0.918 0.589 CB 1.467 74 residues pruned to eliminate duplicates Z: 14 37.789 2.429 0.902 0.915 1.000 0.769 CB 1.604 Z: 16 26.042 2.060 0.626 0.894 1.000 0.867 CA 1.439 Z: 10 20.096 2.087 0.775 0.792 0.889 0.889 CB 1.574 10 residues pruned to eliminate duplicates Z: 17 47.487 2.317 1.174 0.929 1.000 0.812 CB 1.649 17 residues pruned to eliminate duplicates Z: 10 18.997 2.255 0.548 0.916 1.000 0.889 CB 1.281 Z: 16 34.095 2.410 0.868 0.789 0.933 0.467 CB 1.625 14 residues pruned to eliminate duplicates Z: 26 16.105 2.113 0.548 0.323 0.800 0.440 CA 1.497 26 residues pruned to eliminate duplicates Z: 18 40.980 2.276 1.035 0.936 0.941 0.765 CB 1.588 18 residues pruned to eliminate duplicates Z: 15 38.734 2.322 0.999 0.880 1.000 0.500 CA 1.617 15 residues pruned to eliminate duplicates Z: 59 63.319 2.391 0.996 0.599 0.931 0.672 CB 1.702 59 residues pruned to eliminate duplicates Z: 15 37.477 2.219 0.845 0.908 1.000 0.643 CB 1.737 15 residues pruned to eliminate duplicates Z: 17 18.393 2.062 0.797 0.488 0.875 0.375 CB 1.434 Z: 166 104.267 2.393 0.973 0.580 0.933 0.655 CB 1.705 163 residues pruned to eliminate duplicates Z: 10 23.507 2.130 0.630 0.819 1.000 0.889 CB 1.711 Z: 10 25.389 2.209 0.720 0.902 1.000 0.778 CB 1.589 10 residues pruned to eliminate duplicates Z: 86 68.496 2.241 1.016 0.622 0.941 0.635 CB 1.557 56 residues pruned to eliminate duplicates Z: 83 82.125 2.355 1.101 0.661 0.951 0.720 CB 1.659 84 residues pruned to eliminate duplicates Z: 16 19.701 2.176 0.367 0.828 0.867 0.733 CA 1.486 16 residues pruned to eliminate duplicates Z: 16 31.971 2.209 0.811 0.886 1.000 0.733 CA 1.488 16 residues pruned to eliminate duplicates Z: 13 37.113 2.398 1.076 0.857 0.917 0.583 CA 1.730 13 residues pruned to eliminate duplicates Z: 144 88.361 2.298 0.990 0.608 0.916 0.615 CB 1.592 142 residues pruned to eliminate duplicates Z: 13 40.120 2.333 1.320 0.808 0.917 0.667 CB 1.784 13 residues pruned to eliminate duplicates Z: 18 41.776 2.222 0.976 0.909 1.000 0.647 CB 1.637 18 residues pruned to eliminate duplicates Z: 116 78.982 2.418 0.886 0.538 0.896 0.670 CB 1.736 116 residues pruned to eliminate duplicates Z: 9 27.191 2.383 0.706 0.917 1.000 0.875 CB 1.670 10 residues pruned to eliminate duplicates Z: 12 45.976 2.585 1.347 0.890 0.909 0.818 CA 1.809 12 residues pruned to eliminate duplicates Z: 45 49.844 2.368 0.978 0.551 0.909 0.591 CB 1.679 45 residues pruned to eliminate duplicates Z: 10 15.982 2.048 0.632 0.773 0.889 0.778 CA 1.409 10 residues pruned to eliminate duplicates Z: 13 42.568 2.409 1.146 0.893 1.000 0.750 CA 1.706 13 residues pruned to eliminate duplicates Z: 38 51.007 2.351 1.086 0.566 0.946 0.676 CA 1.695 38 residues pruned to eliminate duplicates Z: 8 28.520 2.449 0.858 0.830 1.000 0.714 CB 1.782 8 residues pruned to eliminate duplicates Z: 13 45.797 2.502 0.987 0.911 1.000 0.833 CA 1.885 13 residues pruned to eliminate duplicates Z: 16 34.560 2.125 1.214 0.926 1.000 0.667 CB 1.330 Z: 13 39.980 2.427 1.190 0.910 0.917 0.833 CA 1.681 13 residues pruned to eliminate duplicates Z: 16 34.516 2.404 0.920 0.777 0.867 0.667 CB 1.745 16 residues pruned to eliminate duplicates Z: 13 30.244 2.539 0.535 0.937 0.917 0.833 CA 1.700 13 residues pruned to eliminate duplicates Z: 66 56.697 2.242 0.965 0.625 0.923 0.631 CB 1.537 66 residues pruned to eliminate duplicates Z: 69 50.356 2.344 0.799 0.486 0.853 0.574 CB 1.722 85 residues pruned to eliminate duplicates Z: 114 77.044 2.384 0.893 0.530 0.903 0.619 CB 1.727 114 residues pruned to eliminate duplicates Z: 17 45.441 2.281 1.043 0.941 1.000 0.750 CA 1.692 17 residues pruned to eliminate duplicates Z: 13 42.108 2.366 1.277 0.896 0.917 0.667 CA 1.763 13 residues pruned to eliminate duplicates Z: 14 28.907 2.176 1.054 0.870 0.846 0.462 CB 1.548 14 residues pruned to eliminate duplicates Z: 70 63.530 2.236 0.986 0.669 0.928 0.638 CB 1.588 70 residues pruned to eliminate duplicates Z: 26 20.542 2.203 0.836 0.290 0.800 0.520 CA 1.608 Z: 16 45.960 2.359 0.937 0.945 1.000 0.800 CB 1.797 16 residues pruned to eliminate duplicates Z: 10 18.323 2.160 0.886 0.600 0.889 0.667 CB 1.534 10 residues pruned to eliminate duplicates Z: 16 35.754 2.117 1.099 0.939 1.000 0.800 CB 1.444 16 residues pruned to eliminate duplicates Z: 60 44.236 2.260 0.844 0.499 0.915 0.627 CB 1.512 53 residues pruned to eliminate duplicates Z: 18 38.811 2.162 1.061 0.864 1.000 0.647 CB 1.549 18 residues pruned to eliminate duplicates Z: 72 73.164 2.337 1.090 0.656 0.930 0.592 CB 1.655 72 residues pruned to eliminate duplicates Z: 81 75.100 2.326 1.043 0.657 0.925 0.575 CB 1.651 82 residues pruned to eliminate duplicates Z: 14 29.199 2.211 0.686 0.895 1.000 0.923 CA 1.558 14 residues pruned to eliminate duplicates Z: 9 25.384 2.368 0.678 0.805 1.000 0.750 CA 1.731 9 residues pruned to eliminate duplicates Z: 20 19.509 2.092 0.735 0.449 0.895 0.474 CB 1.452 15 residues pruned to eliminate duplicates Z: 16 45.797 2.348 0.975 0.924 1.000 0.933 CA 1.791 16 residues pruned to eliminate duplicates Z: 14 37.686 2.270 0.954 0.940 1.000 0.923 CB 1.637 14 residues pruned to eliminate duplicates Z: 57 65.223 2.368 0.994 0.625 0.982 0.625 CB 1.671 57 residues pruned to eliminate duplicates Z: 79 70.105 2.288 0.994 0.636 0.936 0.564 CB 1.636 77 residues pruned to eliminate duplicates Z: 17 40.761 2.239 1.061 0.890 0.938 0.812 CB 1.695 17 residues pruned to eliminate duplicates Z: 15 41.380 2.209 1.304 0.936 1.000 0.714 CA 1.513 Z: 16 39.578 2.410 1.032 0.903 0.933 0.467 CB 1.594 16 residues pruned to eliminate duplicates Z: 11 20.502 2.213 0.681 0.761 0.900 0.700 CB 1.536 Z: 15 35.397 2.261 0.865 0.901 0.929 0.500 CB 1.725 15 residues pruned to eliminate duplicates Z: 10 24.090 2.253 0.562 0.886 1.000 0.778 CB 1.647 10 residues pruned to eliminate duplicates Z: 13 35.780 2.413 1.053 0.869 0.833 0.667 CA 1.827 13 residues pruned to eliminate duplicates Z: 60 62.624 2.413 0.908 0.603 0.932 0.678 CB 1.722 60 residues pruned to eliminate duplicates Z: 14 35.841 2.305 0.829 0.937 1.000 0.846 CB 1.641 14 residues pruned to eliminate duplicates Z: 17 39.229 2.265 1.002 0.920 1.000 0.750 CB 1.523 17 residues pruned to eliminate duplicates Z: 11 13.769 1.888 0.726 0.706 0.900 0.500 CA 1.231 Z: 91 61.851 2.206 0.883 0.612 0.922 0.544 CB 1.530 91 residues pruned to eliminate duplicates Z: 16 36.646 2.288 0.770 0.934 1.000 0.733 CB 1.629 16 residues pruned to eliminate duplicates Z: 90 68.113 2.175 0.979 0.628 0.955 0.652 CB 1.557 40 residues pruned to eliminate duplicates Z: 17 44.041 2.317 1.049 0.923 1.000 0.500 CB 1.630 17 residues pruned to eliminate duplicates Z: 115 74.843 2.139 1.047 0.610 0.939 0.632 CB 1.536 87 residues pruned to eliminate duplicates Z: 10 22.021 2.064 0.944 0.822 1.000 0.667 CA 1.384 10 residues pruned to eliminate duplicates Z: 16 25.442 2.035 0.646 0.922 0.933 0.867 CA 1.478 16 residues pruned to eliminate duplicates Z: 9 21.316 2.306 0.489 0.917 1.000 0.875 CB 1.549 10 residues pruned to eliminate duplicates Z: 22 16.434 1.999 0.689 0.357 0.810 0.524 CB 1.530 22 residues pruned to eliminate duplicates Z: 9 16.412 2.168 0.811 0.797 0.750 0.500 CB 1.519 9 residues pruned to eliminate duplicates Z: 136 89.847 2.298 0.996 0.635 0.933 0.659 CB 1.591 136 residues pruned to eliminate duplicates Z: 54 37.525 2.172 0.644 0.532 0.925 0.698 CB 1.513 11 residues pruned to eliminate duplicates Z: 82 68.129 2.269 0.992 0.616 0.914 0.630 CB 1.643 82 residues pruned to eliminate duplicates Z: 15 37.586 2.311 0.904 0.920 1.000 0.857 CB 1.608 15 residues pruned to eliminate duplicates Z: 26 18.683 2.103 0.671 0.392 0.800 0.440 CB 1.490 26 residues pruned to eliminate duplicates Z: 84 79.897 2.301 1.034 0.689 0.952 0.663 CB 1.656 82 residues pruned to eliminate duplicates Z: 12 15.476 1.912 0.494 0.715 0.909 0.455 CA 1.478 12 residues pruned to eliminate duplicates Z: 12 45.213 2.586 1.080 0.930 0.909 0.545 CA 1.950 12 residues pruned to eliminate duplicates Z: 15 41.821 2.226 1.197 0.933 1.000 0.429 CA 1.595 15 residues pruned to eliminate duplicates Z: 47 33.856 2.163 0.605 0.569 0.935 0.674 CB 1.440 47 residues pruned to eliminate duplicates Z: 13 27.464 2.145 0.792 0.919 1.000 1.000 CA 1.454 13 residues pruned to eliminate duplicates Z: 14 27.247 2.388 0.665 0.870 0.923 0.769 CA 1.502 Z: 9 12.840 2.270 0.558 0.738 0.750 0.500 CB 1.383 9 residues pruned to eliminate duplicates Z: 9 21.400 2.154 1.163 0.795 0.875 0.625 CB 1.433 9 residues pruned to eliminate duplicates Z: 15 31.375 2.274 0.754 0.928 1.000 0.857 CA 1.473 15 residues pruned to eliminate duplicates Z: 46 45.372 2.228 0.979 0.623 0.889 0.600 CB 1.537 46 residues pruned to eliminate duplicates Z: 15 34.004 2.197 1.030 0.900 1.000 0.929 CA 1.455 15 residues pruned to eliminate duplicates Z: 70 62.223 2.182 1.034 0.627 0.942 0.667 CB 1.590 73 residues pruned to eliminate duplicates Z: 16 33.699 2.173 0.979 0.926 1.000 0.867 CA 1.419 16 residues pruned to eliminate duplicates Z: 20 17.026 2.092 0.931 0.339 0.737 0.579 CB 1.565 20 residues pruned to eliminate duplicates Z: 70 70.667 2.257 1.117 0.678 0.942 0.638 CB 1.605 70 residues pruned to eliminate duplicates Z: 9 27.223 2.311 0.815 0.924 1.000 0.875 CB 1.612 9 residues pruned to eliminate duplicates Z: 14 31.168 2.349 0.798 0.876 1.000 0.615 CA 1.488 14 residues pruned to eliminate duplicates Z: 15 37.706 2.244 1.098 0.936 1.000 0.929 CA 1.491 15 residues pruned to eliminate duplicates Z: 9 13.203 2.165 0.835 0.470 0.875 0.875 CA 1.383 9 residues pruned to eliminate duplicates Z: 16 43.276 2.267 1.237 0.890 0.933 0.733 CA 1.697 16 residues pruned to eliminate duplicates Z: 10 17.808 2.039 0.943 0.779 0.889 0.778 CB 1.319 10 residues pruned to eliminate duplicates Z: 30 37.134 2.262 0.852 0.558 0.897 0.517 CB 1.735 30 residues pruned to eliminate duplicates Z: 16 50.207 2.397 1.209 0.952 0.933 0.733 CB 1.806 16 residues pruned to eliminate duplicates Z: 13 17.539 1.832 0.858 0.703 0.917 0.500 CB 1.349 13 residues pruned to eliminate duplicates Z: 15 26.615 2.242 0.604 0.934 1.000 0.929 CB 1.380 15 residues pruned to eliminate duplicates Z: 22 40.986 2.347 1.127 0.651 1.000 0.571 CB 1.558 17 residues pruned to eliminate duplicates Z: 15 32.170 2.182 1.044 0.901 0.929 0.571 CB 1.482 16 residues pruned to eliminate duplicates Z: 13 28.145 2.118 0.741 0.895 1.000 0.833 CB 1.579 13 residues pruned to eliminate duplicates Z: 11 23.195 2.001 0.915 0.811 1.000 0.700 CA 1.460 11 residues pruned to eliminate duplicates Z: 20 22.342 2.174 0.817 0.550 0.842 0.684 CB 1.467 19 residues pruned to eliminate duplicates Z: 11 15.407 1.952 0.580 0.877 0.900 0.800 CB 1.275 Z: 16 31.862 2.164 0.942 0.868 0.933 0.733 CA 1.533 17 residues pruned to eliminate duplicates Z: 13 41.575 2.546 0.861 0.950 1.000 0.917 CA 1.747 13 residues pruned to eliminate duplicates Z: 30 16.133 1.973 0.556 0.432 0.828 0.586 CB 1.265 30 residues pruned to eliminate duplicates Z: 6 3.720 1.689 0.293 0.346 0.800 0.600 C 1.126 6 residues pruned to eliminate duplicates Z: 12 17.003 1.826 0.762 0.718 1.000 0.545 CB 1.308 12 residues pruned to eliminate duplicates Z: 9 12.392 2.035 0.932 0.365 0.875 0.500 CB 1.472 Z: 10 20.286 2.062 1.042 0.827 0.889 0.778 CA 1.362 10 residues pruned to eliminate duplicates Z: 10 20.505 2.042 1.068 0.692 1.000 0.556 CA 1.357 10 residues pruned to eliminate duplicates Z: 72 70.239 2.356 1.150 0.643 0.901 0.563 CB 1.598 64 residues pruned to eliminate duplicates Z: 14 35.211 2.284 1.039 0.870 1.000 0.769 CA 1.530 14 residues pruned to eliminate duplicates Z: 46 36.413 2.184 0.779 0.567 0.889 0.644 CB 1.472 46 residues pruned to eliminate duplicates Z: 17 24.237 1.987 0.625 0.907 1.000 0.875 CA 1.334 17 residues pruned to eliminate duplicates Z: 10 22.421 2.220 0.509 0.894 1.000 1.000 CA 1.601 10 residues pruned to eliminate duplicates Z: 17 27.755 2.268 0.843 0.773 0.938 0.688 CB 1.391 17 residues pruned to eliminate duplicates Z: 16 48.689 2.391 1.119 0.937 1.000 0.733 CB 1.727 16 residues pruned to eliminate duplicates Z: 13 37.912 2.493 0.771 0.916 1.000 0.833 CA 1.750 13 residues pruned to eliminate duplicates Z: 10 16.341 2.141 0.335 0.918 1.000 0.778 CB 1.343 10 residues pruned to eliminate duplicates Z: 87 62.473 2.189 0.887 0.590 0.965 0.628 CB 1.551 87 residues pruned to eliminate duplicates Z: 140 93.371 2.390 0.934 0.607 0.906 0.662 CB 1.707 96 residues pruned to eliminate duplicates Z: 104 70.593 2.185 1.000 0.607 0.951 0.602 CB 1.511 105 residues pruned to eliminate duplicates Z: 12 14.020 2.018 0.625 0.758 0.818 0.636 CA 1.252 12 residues pruned to eliminate duplicates Z: 9 16.760 2.416 0.215 0.813 0.875 0.875 CB 1.758 9 residues pruned to eliminate duplicates Z: 13 31.965 2.308 0.950 0.883 0.833 0.500 CB 1.778 13 residues pruned to eliminate duplicates Z: 89 71.557 2.271 1.010 0.611 0.932 0.625 CB 1.613 89 residues pruned to eliminate duplicates Z: 8 7.618 1.766 0.300 0.660 0.857 0.857 CA 1.261 Z: 12 50.939 2.625 1.384 0.923 0.909 0.909 CA 1.898 12 residues pruned to eliminate duplicates Z: 16 51.432 2.406 1.277 0.930 1.000 0.600 CB 1.695 16 residues pruned to eliminate duplicates Z: 147 92.951 2.310 0.995 0.623 0.932 0.678 CB 1.596 144 residues pruned to eliminate duplicates Z: 10 24.744 2.244 0.841 0.927 1.000 0.889 CB 1.399 10 residues pruned to eliminate duplicates Z: 14 32.873 2.409 0.685 0.910 1.000 0.923 CA 1.593 14 residues pruned to eliminate duplicates Z: 12 17.583 1.880 1.145 0.750 0.818 0.545 CB 1.285 12 residues pruned to eliminate duplicates Z: 23 20.770 2.201 0.589 0.477 0.864 0.682 CB 1.501 12 residues pruned to eliminate duplicates Z: 90 67.456 2.156 0.982 0.629 0.955 0.607 CB 1.552 87 residues pruned to eliminate duplicates Z: 12 16.602 1.747 1.037 0.788 1.000 0.727 CB 1.092 12 residues pruned to eliminate duplicates Z: 31 29.206 2.179 0.766 0.472 0.933 0.567 CB 1.528 31 residues pruned to eliminate duplicates Z: 11 14.291 1.961 0.555 0.867 0.900 0.700 CB 1.204 11 residues pruned to eliminate duplicates Z: 33 35.819 2.123 0.979 0.604 0.875 0.562 CB 1.560 33 residues pruned to eliminate duplicates Z: 11 14.633 1.960 0.537 0.847 0.900 0.700 CB 1.267 11 residues pruned to eliminate duplicates Z: 10 16.893 2.102 0.350 0.871 1.000 0.889 CA 1.447 10 residues pruned to eliminate duplicates Z: 120 73.771 2.122 1.055 0.620 0.908 0.655 CB 1.526 120 residues pruned to eliminate duplicates Z: 9 15.576 2.027 0.849 0.574 1.000 0.625 CB 1.368 9 residues pruned to eliminate duplicates Z: 87 68.464 2.243 0.939 0.653 0.965 0.674 CB 1.526 87 residues pruned to eliminate duplicates Z: 9 25.107 2.172 0.978 0.875 1.000 0.625 CA 1.503 9 residues pruned to eliminate duplicates Z: 12 19.411 1.988 1.196 0.544 0.909 0.455 CA 1.413 12 residues pruned to eliminate duplicates Z: 86 82.540 2.329 1.112 0.655 0.953 0.671 CB 1.653 87 residues pruned to eliminate duplicates Z: 115 69.248 2.220 0.941 0.552 0.930 0.614 CB 1.538 115 residues pruned to eliminate duplicates Z: 145 88.498 2.291 0.998 0.624 0.917 0.681 CB 1.564 145 residues pruned to eliminate duplicates Z: 13 44.932 2.460 1.044 0.939 1.000 0.833 CB 1.792 13 residues pruned to eliminate duplicates Z: 26 45.379 2.448 1.086 0.650 0.920 0.480 CB 1.680 26 residues pruned to eliminate duplicates Z: 16 25.807 2.239 1.247 0.435 0.933 0.533 CA 1.518 16 residues pruned to eliminate duplicates Z: 9 21.628 2.220 1.043 0.781 0.875 0.750 CA 1.504 9 residues pruned to eliminate duplicates Z: 14 29.615 2.193 0.957 0.924 0.923 0.769 CB 1.456 14 residues pruned to eliminate duplicates Z: 14 39.404 2.246 1.193 0.853 0.923 0.538 CB 1.776 14 residues pruned to eliminate duplicates Z: 14 19.138 1.981 0.851 0.903 0.923 0.846 CB 1.117 14 residues pruned to eliminate duplicates Z: 6 9.010 1.963 -0.015 0.799 1.000 0.800 N 1.604 6 residues pruned to eliminate duplicates Z: 89 70.101 2.174 1.010 0.648 0.943 0.670 CB 1.579 89 residues pruned to eliminate duplicates Z: 81 67.147 2.277 0.965 0.623 0.900 0.725 CB 1.660 81 residues pruned to eliminate duplicates Z: 7 8.774 2.091 0.683 0.459 0.667 0.333 CA 1.592 7 residues pruned to eliminate duplicates Z: 13 30.573 2.321 0.738 0.876 0.917 0.500 CA 1.736 13 residues pruned to eliminate duplicates Z: 15 34.555 2.232 1.079 0.936 1.000 0.929 CB 1.386 15 residues pruned to eliminate duplicates Z: 11 15.524 1.912 0.538 0.772 1.000 0.800 CA 1.313 11 residues pruned to eliminate duplicates Z: 12 49.330 2.593 1.101 0.936 1.000 0.909 CA 1.901 12 residues pruned to eliminate duplicates Z: 14 21.223 1.984 0.768 0.937 1.000 0.923 CB 1.168 14 residues pruned to eliminate duplicates Z: 17 31.258 2.026 0.881 0.936 1.000 0.812 CA 1.428 17 residues pruned to eliminate duplicates Z: 10 24.270 2.325 0.646 0.839 1.000 0.778 CA 1.578 10 residues pruned to eliminate duplicates Z: 14 35.704 2.298 0.821 0.933 1.000 1.000 CA 1.651 14 residues pruned to eliminate duplicates Z: 43 51.653 2.288 1.011 0.635 0.952 0.595 CB 1.602 43 residues pruned to eliminate duplicates Z: 17 42.322 2.033 1.379 0.946 1.000 0.812 CB 1.513 17 residues pruned to eliminate duplicates Z: 82 75.293 2.333 0.937 0.646 0.951 0.728 CB 1.699 82 residues pruned to eliminate duplicates Z: 12 21.870 2.077 0.651 0.877 0.909 0.818 CA 1.537 12 residues pruned to eliminate duplicates Z: 16 39.628 2.371 0.936 0.927 0.933 0.733 CB 1.673 16 residues pruned to eliminate duplicates Z: 15 27.056 2.141 0.746 0.890 0.929 0.643 CA 1.499 15 residues pruned to eliminate duplicates Z: 11 14.690 2.156 0.250 0.766 1.000 0.800 CB 1.361 11 residues pruned to eliminate duplicates Z: 17 32.024 2.225 1.078 0.753 0.875 0.750 CA 1.578 17 residues pruned to eliminate duplicates Z: 16 41.739 2.406 0.889 0.928 1.000 0.867 CB 1.661 16 residues pruned to eliminate duplicates Z: 62 65.344 2.388 1.057 0.565 0.934 0.443 CB 1.711 61 residues pruned to eliminate duplicates Z: 18 32.419 2.165 0.790 0.876 0.941 0.647 CB 1.566 18 residues pruned to eliminate duplicates Z: 14 34.215 2.293 0.849 0.933 1.000 0.923 CA 1.562 14 residues pruned to eliminate duplicates Z: 19 39.120 2.349 1.208 0.813 0.889 0.778 CB 1.523 19 residues pruned to eliminate duplicates Z: 110 72.447 2.229 1.003 0.586 0.927 0.514 CB 1.546 110 residues pruned to eliminate duplicates Z: 24 19.524 2.122 0.642 0.438 0.826 0.565 CB 1.508 24 residues pruned to eliminate duplicates Z: 28 33.675 2.287 0.995 0.368 0.963 0.667 CA 1.699 29 residues pruned to eliminate duplicates Z: 15 29.180 2.085 0.987 0.893 0.929 0.357 CB 1.456 15 residues pruned to eliminate duplicates Z: 6 4.147 1.590 0.103 0.493 0.800 0.800 C 1.332 6 residues pruned to eliminate duplicates Z: 85 64.781 2.167 0.998 0.651 0.917 0.690 CB 1.547 85 residues pruned to eliminate duplicates Z: 12 30.125 2.229 0.877 0.914 1.000 0.818 CB 1.535 12 residues pruned to eliminate duplicates Z: 15 33.805 2.236 0.865 0.935 1.000 0.929 CA 1.510 15 residues pruned to eliminate duplicates Z: 8 8.240 1.627 0.639 0.781 0.857 0.429 N 1.064 8 residues pruned to eliminate duplicates Z: 15 23.117 2.073 0.426 0.941 1.000 1.000 CB 1.450 15 residues pruned to eliminate duplicates Z: 9 6.864 1.773 0.356 0.443 1.000 0.625 CB 1.071 Z: 107 86.273 2.330 1.039 0.632 0.943 0.689 CB 1.652 107 residues pruned to eliminate duplicates Z: 119 84.792 2.333 0.959 0.638 0.941 0.627 CB 1.595 119 residues pruned to eliminate duplicates Z: 75 68.697 2.329 0.886 0.636 0.946 0.649 CB 1.692 75 residues pruned to eliminate duplicates Z: 143 96.936 2.383 0.964 0.610 0.930 0.690 CB 1.684 143 residues pruned to eliminate duplicates Z: 14 16.659 1.976 0.293 0.799 1.000 0.692 CB 1.392 14 residues pruned to eliminate duplicates Z: 101 77.295 2.324 1.036 0.589 0.920 0.610 CB 1.630 101 residues pruned to eliminate duplicates Z: 18 16.685 1.966 0.365 0.563 1.000 0.529 CB 1.418 Z: 33 46.342 2.408 1.094 0.572 0.906 0.625 CB 1.673 33 residues pruned to eliminate duplicates Z: 36 20.076 2.079 0.550 0.397 0.829 0.514 CB 1.418 32 residues pruned to eliminate duplicates Z: 6 10.041 1.826 0.594 0.757 1.000 0.800 CB 1.228 6 residues pruned to eliminate duplicates Z: 13 17.172 1.958 0.470 0.878 0.917 0.833 CB 1.363 13 residues pruned to eliminate duplicates Z: 16 30.089 2.069 1.025 0.906 0.933 0.533 CA 1.413 16 residues pruned to eliminate duplicates Z: 85 56.415 2.231 0.907 0.513 0.952 0.583 CB 1.500 80 residues pruned to eliminate duplicates Z: 38 36.374 2.208 0.923 0.585 0.865 0.568 CB 1.500 38 residues pruned to eliminate duplicates Z: 14 28.602 2.037 1.126 0.865 0.923 0.692 CA 1.454 14 residues pruned to eliminate duplicates Z: 19 21.069 2.189 0.669 0.455 0.944 0.611 CB 1.507 19 residues pruned to eliminate duplicates Z: 37 18.470 1.865 0.425 0.420 0.917 0.694 CB 1.372 Z: 10 22.722 2.138 0.912 0.799 1.000 0.778 CA 1.425 10 residues pruned to eliminate duplicates Z: 88 74.061 2.288 0.977 0.635 0.931 0.575 CB 1.661 88 residues pruned to eliminate duplicates Z: 119 89.272 2.322 1.102 0.630 0.949 0.585 CB 1.570 119 residues pruned to eliminate duplicates Z: 15 16.744 1.812 0.271 0.924 1.000 0.786 CA 1.366 15 residues pruned to eliminate duplicates Z: 96 79.597 2.362 1.019 0.602 0.926 0.632 CB 1.678 96 residues pruned to eliminate duplicates Z: 13 33.999 2.210 0.988 0.937 1.000 0.833 CB 1.555 13 residues pruned to eliminate duplicates Z: 35 33.455 2.227 0.754 0.542 0.941 0.706 CB 1.498 35 residues pruned to eliminate duplicates Z: 10 10.539 1.799 0.162 0.596 1.000 0.667 CB 1.533 Z: 9 8.673 1.878 0.229 0.557 0.875 0.750 CB 1.437 9 residues pruned to eliminate duplicates Z: 11 22.046 2.019 0.645 0.841 1.000 0.600 CA 1.565 9 residues pruned to eliminate duplicates Z: 114 87.351 2.320 1.056 0.631 0.938 0.655 CB 1.624 114 residues pruned to eliminate duplicates Z: 83 73.139 2.339 0.971 0.625 0.939 0.634 CB 1.658 83 residues pruned to eliminate duplicates Z: 18 9.352 1.799 0.480 0.264 0.824 0.529 CA 1.353 18 residues pruned to eliminate duplicates Z: 11 17.405 1.913 0.573 0.908 1.000 0.800 CB 1.299 11 residues pruned to eliminate duplicates Z: 11 17.102 2.088 0.609 0.814 1.000 0.800 CB 1.225 11 residues pruned to eliminate duplicates Z: 10 18.840 1.928 0.783 0.895 1.000 0.667 CB 1.310 10 residues pruned to eliminate duplicates Z: 15 14.049 2.034 0.508 0.532 0.929 0.500 CB 1.277 15 residues pruned to eliminate duplicates Z: 10 15.958 2.099 0.488 0.828 0.889 0.778 CB 1.443 10 residues pruned to eliminate duplicates Z: 13 33.993 2.193 1.014 0.921 1.000 0.917 CA 1.564 13 residues pruned to eliminate duplicates Z: 114 74.681 2.310 0.950 0.548 0.903 0.628 CB 1.649 114 residues pruned to eliminate duplicates Z: 14 47.799 2.322 1.335 0.914 1.000 0.769 CA 1.729 14 residues pruned to eliminate duplicates Z: 61 56.550 2.408 0.825 0.551 0.917 0.550 CB 1.724 61 residues pruned to eliminate duplicates Z: 16 38.345 2.111 1.168 0.947 1.000 0.867 CA 1.495 16 residues pruned to eliminate duplicates Z: 17 49.111 2.331 1.203 0.942 0.938 0.812 CB 1.768 17 residues pruned to eliminate duplicates Z: 9 29.780 2.300 1.137 0.921 1.000 0.875 CB 1.507 9 residues pruned to eliminate duplicates Z: 15 16.433 1.896 0.521 0.779 0.929 0.500 CB 1.282 15 residues pruned to eliminate duplicates Z: 78 47.435 2.269 0.733 0.461 0.896 0.597 CB 1.596 78 residues pruned to eliminate duplicates Z: 65 60.890 2.327 1.139 0.587 0.859 0.500 CB 1.637 65 residues pruned to eliminate duplicates Z: 9 10.254 1.892 0.612 0.636 0.750 0.750 CA 1.395 9 residues pruned to eliminate duplicates Z: 15 33.871 2.204 1.007 0.892 1.000 0.571 CA 1.470 15 residues pruned to eliminate duplicates Z: 16 27.259 2.099 1.107 0.855 0.933 0.667 CB 1.258 16 residues pruned to eliminate duplicates Z: 13 31.471 2.125 1.065 0.871 1.000 0.750 CB 1.510 13 residues pruned to eliminate duplicates Z: 75 55.721 2.147 0.854 0.615 0.946 0.635 CB 1.544 75 residues pruned to eliminate duplicates Z: 14 6.796 1.556 0.730 0.248 0.769 0.538 CB 1.216 14 residues pruned to eliminate duplicates Z: 94 51.847 2.195 0.751 0.504 0.903 0.645 CB 1.542 94 residues pruned to eliminate duplicates Z: 14 30.442 2.299 0.460 0.920 0.923 0.923 CA 1.920 14 residues pruned to eliminate duplicates Z: 17 42.665 2.375 1.169 0.903 0.938 0.625 CB 1.575 17 residues pruned to eliminate duplicates Z: 18 21.357 1.923 0.557 0.891 0.941 0.647 CA 1.322 18 residues pruned to eliminate duplicates Z: 40 19.778 1.971 0.591 0.334 0.846 0.487 CB 1.431 45 residues pruned to eliminate duplicates Z: 17 31.001 2.051 1.028 0.919 0.938 0.875 CA 1.401 17 residues pruned to eliminate duplicates Z: 13 15.148 2.056 0.479 0.763 0.833 0.500 CB 1.366 13 residues pruned to eliminate duplicates Z: 16 18.266 1.817 0.935 0.840 0.867 0.600 CB 1.155 16 residues pruned to eliminate duplicates Z: 15 19.358 1.903 0.949 0.836 0.929 0.929 CB 1.125 15 residues pruned to eliminate duplicates Z: 81 55.692 2.222 0.930 0.577 0.875 0.562 CB 1.541 81 residues pruned to eliminate duplicates Z: 15 37.931 2.196 1.108 0.906 1.000 0.714 CB 1.558 15 residues pruned to eliminate duplicates Z: 17 21.691 1.957 0.589 0.855 0.938 0.875 CB 1.373 17 residues pruned to eliminate duplicates Z: 12 12.970 1.922 1.021 0.238 1.000 0.545 CB 1.364 12 residues pruned to eliminate duplicates Z: 8 8.579 1.831 0.656 0.558 0.857 0.714 CA 1.180 9 residues pruned to eliminate duplicates Z: 16 39.388 2.124 1.166 0.948 1.000 0.867 CA 1.527 16 residues pruned to eliminate duplicates Z: 20 33.508 2.028 0.996 0.805 1.000 0.474 CA 1.455 20 residues pruned to eliminate duplicates Z: 15 35.599 2.160 1.044 0.936 1.000 0.857 CB 1.501 15 residues pruned to eliminate duplicates Z: 15 26.953 2.100 1.120 0.892 0.929 0.929 CB 1.252 15 residues pruned to eliminate duplicates Z: 11 11.548 1.903 0.860 0.340 0.900 0.700 CA 1.365 11 residues pruned to eliminate duplicates Z: 12 21.510 2.112 0.545 0.859 0.909 0.727 CB 1.608 12 residues pruned to eliminate duplicates Z: 16 33.316 2.113 0.898 0.909 1.000 0.667 CB 1.522 16 residues pruned to eliminate duplicates Z: 10 16.344 2.186 0.157 0.908 1.000 1.000 CA 1.531 10 residues pruned to eliminate duplicates Z: 17 41.073 2.298 1.237 0.903 0.875 0.688 CB 1.628 17 residues pruned to eliminate duplicates Z: 15 32.333 2.199 1.053 0.918 0.929 0.857 CA 1.453 15 residues pruned to eliminate duplicates Z: 13 12.222 2.052 0.735 0.309 0.750 0.417 CA 1.633 13 residues pruned to eliminate duplicates Z: 10 11.129 1.873 0.316 0.858 1.000 0.778 CB 1.109 10 residues pruned to eliminate duplicates Z: 11 17.117 2.006 0.369 0.868 1.000 1.000 CA 1.440 11 residues pruned to eliminate duplicates Z: 17 51.492 2.305 1.274 0.940 1.000 0.750 CB 1.706 17 residues pruned to eliminate duplicates Z: 106 80.574 2.274 1.072 0.608 0.943 0.610 CB 1.598 106 residues pruned to eliminate duplicates Z: 60 60.396 2.271 0.948 0.622 0.932 0.559 CB 1.700 60 residues pruned to eliminate duplicates Z: 42 40.931 2.089 0.971 0.643 0.902 0.707 CB 1.505 42 residues pruned to eliminate duplicates Z: 21 34.922 1.965 1.184 0.833 1.000 0.850 CA 1.365 21 residues pruned to eliminate duplicates Z: 11 18.972 1.930 0.760 0.811 1.000 0.800 CA 1.347 11 residues pruned to eliminate duplicates Z: 9 7.417 1.961 -0.138 0.673 0.875 0.500 CB 1.511 Z: 46 39.157 2.152 0.802 0.600 0.956 0.689 CB 1.432 46 residues pruned to eliminate duplicates Z: 10 12.650 1.843 0.366 0.930 1.000 0.889 CB 1.171 Z: 16 58.192 2.391 1.356 0.942 1.000 0.400 CB 1.850 16 residues pruned to eliminate duplicates Z: 14 37.461 2.208 1.205 0.933 0.923 0.538 CB 1.612 14 residues pruned to eliminate duplicates Z: 25 23.157 2.037 0.640 0.510 0.958 0.625 CA 1.462 26 residues pruned to eliminate duplicates Z: 95 80.485 2.368 1.068 0.605 0.904 0.606 CB 1.697 95 residues pruned to eliminate duplicates Z: 82 81.307 2.340 1.119 0.646 0.951 0.642 CB 1.672 82 residues pruned to eliminate duplicates Z: 15 35.059 2.219 1.057 0.918 1.000 0.714 CA 1.447 15 residues pruned to eliminate duplicates Z: 15 25.395 2.236 0.712 0.779 0.857 0.786 CB 1.618 15 residues pruned to eliminate duplicates Z: 86 65.221 2.382 0.951 0.510 0.906 0.529 CB 1.664 86 residues pruned to eliminate duplicates Z: 10 18.168 2.206 0.480 0.922 1.000 0.778 CB 1.305 10 residues pruned to eliminate duplicates Z: 20 19.559 2.029 0.886 0.441 0.842 0.579 CB 1.480 20 residues pruned to eliminate duplicates Z: 13 26.431 2.129 0.907 0.875 1.000 0.750 CA 1.367 13 residues pruned to eliminate duplicates Z: 21 37.358 2.268 1.034 0.843 0.900 0.700 CB 1.498 21 residues pruned to eliminate duplicates Z: 16 25.294 2.072 0.593 0.904 0.933 0.733 CB 1.509 16 residues pruned to eliminate duplicates Z: 21 42.205 2.421 1.122 0.724 0.900 0.600 CB 1.667 21 residues pruned to eliminate duplicates Z: 10 24.798 2.137 0.939 0.830 1.000 0.222 CA 1.500 10 residues pruned to eliminate duplicates Z: 17 29.392 2.018 0.865 0.915 1.000 0.750 CB 1.380 17 residues pruned to eliminate duplicates Z: 16 24.087 2.082 0.496 0.886 1.000 0.533 CB 1.441 16 residues pruned to eliminate duplicates Z: 19 25.646 1.933 0.968 0.850 0.889 0.722 CA 1.325 19 residues pruned to eliminate duplicates Z: 6 10.714 2.279 0.006 0.785 1.000 0.800 CA 1.627 6 residues pruned to eliminate duplicates Z: 10 19.534 2.004 1.293 0.759 0.889 0.667 CA 1.266 10 residues pruned to eliminate duplicates Z: 122 85.569 2.342 0.981 0.592 0.926 0.669 CB 1.659 122 residues pruned to eliminate duplicates Z: 15 39.528 2.228 1.113 0.943 1.000 0.929 CA 1.554 15 residues pruned to eliminate duplicates Z: 67 58.281 2.285 0.912 0.624 0.939 0.621 CB 1.555 67 residues pruned to eliminate duplicates Z: 10 14.986 1.896 0.933 0.829 0.778 0.556 CB 1.318 Z: 16 26.076 2.159 0.640 0.921 1.000 0.867 CA 1.338 16 residues pruned to eliminate duplicates Z: 111 75.254 2.266 1.004 0.582 0.918 0.627 CB 1.591 111 residues pruned to eliminate duplicates Z: 9 9.887 1.842 0.110 0.820 1.000 1.000 CA 1.295 9 residues pruned to eliminate duplicates Z: 15 34.281 2.243 0.985 0.920 1.000 0.786 CA 1.449 15 residues pruned to eliminate duplicates Z: 9 22.055 2.120 1.095 0.848 0.875 0.500 CA 1.489 9 residues pruned to eliminate duplicates Z: 18 16.824 1.910 0.429 0.583 0.941 0.529 CB 1.466 18 residues pruned to eliminate duplicates Z: 21 16.867 1.973 0.660 0.466 0.900 0.600 CB 1.324 18 residues pruned to eliminate duplicates Z: 10 17.157 2.054 0.865 0.800 0.889 0.778 CB 1.292 10 residues pruned to eliminate duplicates Z: 14 32.837 2.229 0.895 0.881 0.923 0.615 CA 1.691 14 residues pruned to eliminate duplicates Z: 32 22.729 2.216 0.471 0.468 0.806 0.516 CB 1.605 32 residues pruned to eliminate duplicates Z: 11 15.935 1.932 0.702 0.882 0.900 0.500 CB 1.231 11 residues pruned to eliminate duplicates Z: 14 23.055 2.048 0.787 0.904 0.923 0.769 CB 1.348 14 residues pruned to eliminate duplicates Z: 17 23.146 2.111 0.754 0.811 0.938 0.625 CA 1.271 17 residues pruned to eliminate duplicates Z: 23 20.534 2.165 0.689 0.492 0.818 0.591 CB 1.474 23 residues pruned to eliminate duplicates Z: 9 23.048 2.199 1.098 0.836 0.875 0.625 CB 1.511 9 residues pruned to eliminate duplicates Z: 15 45.259 2.418 1.349 0.937 0.929 0.571 CB 1.596 15 residues pruned to eliminate duplicates Z: 9 9.656 1.800 0.271 0.897 1.000 0.875 CB 1.068 9 residues pruned to eliminate duplicates Z: 16 39.403 2.114 1.236 0.930 1.000 0.867 CA 1.505 16 residues pruned to eliminate duplicates Z: 16 17.719 2.078 0.564 0.529 0.867 0.667 CA 1.579 16 residues pruned to eliminate duplicates Z: 11 18.543 2.068 0.385 0.916 1.000 1.000 CB 1.446 11 residues pruned to eliminate duplicates Z: 20 20.305 2.141 0.985 0.334 0.842 0.526 CA 1.560 20 residues pruned to eliminate duplicates Z: 12 18.572 2.057 0.669 0.793 0.909 0.727 CA 1.387 12 residues pruned to eliminate duplicates Z: 13 26.481 2.169 0.901 0.897 0.917 0.667 CB 1.447 13 residues pruned to eliminate duplicates Z: 13 32.839 2.164 1.019 0.892 1.000 0.833 CB 1.559 13 residues pruned to eliminate duplicates Z: 10 13.801 2.090 0.276 0.877 0.889 0.778 CB 1.408 10 residues pruned to eliminate duplicates Z: 23 36.809 2.265 0.960 0.641 0.955 0.545 CB 1.622 23 residues pruned to eliminate duplicates Z: 11 11.736 2.071 0.064 0.814 0.900 0.700 CB 1.424 11 residues pruned to eliminate duplicates Z: 6 4.886 1.912 -0.306 0.739 1.000 0.800 N 1.329 Z: 47 27.643 2.153 0.602 0.411 0.870 0.457 CB 1.491 54 residues pruned to eliminate duplicates Z: 36 53.644 2.322 1.177 0.631 0.914 0.743 CB 1.735 36 residues pruned to eliminate duplicates Z: 14 31.817 2.008 0.990 0.909 1.000 0.769 CB 1.566 14 residues pruned to eliminate duplicates Z: 16 33.657 2.085 0.964 0.927 1.000 0.867 CA 1.486 16 residues pruned to eliminate duplicates Z: 16 26.258 2.089 0.677 0.919 0.933 0.667 CB 1.461 16 residues pruned to eliminate duplicates Z: 48 51.793 2.428 0.824 0.530 0.936 0.681 CB 1.769 48 residues pruned to eliminate duplicates Z: 15 20.655 2.272 1.083 0.302 1.000 0.643 CA 1.454 15 residues pruned to eliminate duplicates Z: 82 77.566 2.324 1.067 0.638 0.951 0.593 CB 1.659 82 residues pruned to eliminate duplicates Z: 31 25.936 2.271 0.601 0.548 0.800 0.600 CB 1.553 31 residues pruned to eliminate duplicates Z: 15 17.419 1.906 0.625 0.805 0.929 0.714 CB 1.241 15 residues pruned to eliminate duplicates Z: 14 18.256 1.981 0.582 0.928 1.000 0.923 CB 1.131 14 residues pruned to eliminate duplicates Z: 21 44.983 2.483 1.059 0.700 0.950 0.650 CA 1.726 21 residues pruned to eliminate duplicates Z: 44 39.707 2.136 0.791 0.648 0.953 0.674 CB 1.446 44 residues pruned to eliminate duplicates Z: 8 14.679 2.078 0.703 0.692 0.857 0.857 CA 1.534 8 residues pruned to eliminate duplicates Z: 8 3.381 1.965 0.043 0.365 0.714 0.429 CB 1.009 8 residues pruned to eliminate duplicates Z: 59 64.351 2.384 0.964 0.592 0.966 0.707 CB 1.712 59 residues pruned to eliminate duplicates Z: 10 16.179 1.911 0.578 0.816 1.000 0.667 CA 1.359 10 residues pruned to eliminate duplicates Z: 85 75.385 2.341 0.954 0.642 0.929 0.667 CB 1.696 85 residues pruned to eliminate duplicates Z: 48 40.690 2.127 0.843 0.597 0.957 0.638 CB 1.441 48 residues pruned to eliminate duplicates Z: 9 17.583 1.908 0.909 0.807 1.000 0.625 CB 1.306 9 residues pruned to eliminate duplicates Z: 13 30.939 2.489 0.476 0.919 1.000 0.833 CA 1.713 13 residues pruned to eliminate duplicates Z: 16 36.277 2.102 0.931 0.939 1.000 0.800 CB 1.604 16 residues pruned to eliminate duplicates Z: 13 38.946 2.400 0.735 0.894 1.000 0.833 CA 1.937 13 residues pruned to eliminate duplicates Z: 7 5.881 1.967 0.709 0.388 0.667 0.500 CB 1.206 5 residues pruned to eliminate duplicates Z: 73 68.081 2.287 0.979 0.644 0.917 0.625 CB 1.690 73 residues pruned to eliminate duplicates Z: 9 11.746 1.858 0.284 0.901 1.000 1.000 CB 1.243 9 residues pruned to eliminate duplicates Z: 143 92.982 2.403 0.991 0.562 0.923 0.655 CB 1.665 143 residues pruned to eliminate duplicates Z: 122 85.486 2.347 1.003 0.583 0.934 0.636 CB 1.635 122 residues pruned to eliminate duplicates Z: 91 60.316 2.143 0.838 0.628 0.911 0.611 CB 1.571 91 residues pruned to eliminate duplicates Z: 15 25.052 2.145 0.676 0.870 0.929 0.857 CA 1.464 15 residues pruned to eliminate duplicates Z: 161 88.236 2.359 0.909 0.536 0.913 0.569 CB 1.639 161 residues pruned to eliminate duplicates Z: 8 15.805 2.136 1.049 0.725 0.857 0.857 CB 1.300 8 residues pruned to eliminate duplicates Z: 24 30.550 2.226 0.869 0.550 0.913 0.478 CA 1.598 24 residues pruned to eliminate duplicates Z: 16 28.836 2.073 0.711 0.901 1.000 0.467 CB 1.499 16 residues pruned to eliminate duplicates Z: 11 16.943 2.007 0.326 0.861 1.000 0.900 CA 1.479 11 residues pruned to eliminate duplicates Z: 16 25.365 2.112 0.874 0.863 0.933 0.733 CB 1.300 16 residues pruned to eliminate duplicates Z: 31 31.414 2.206 0.942 0.498 0.833 0.533 CB 1.609 31 residues pruned to eliminate duplicates Z: 10 15.959 2.041 0.310 0.919 1.000 0.667 CB 1.402 10 residues pruned to eliminate duplicates Z: 15 44.556 2.120 1.503 0.941 1.000 0.714 CB 1.557 15 residues pruned to eliminate duplicates Z: 94 87.403 2.363 1.217 0.624 0.946 0.570 CB 1.626 94 residues pruned to eliminate duplicates Z: 17 27.858 2.031 0.731 0.898 1.000 0.750 CA 1.416 17 residues pruned to eliminate duplicates Z: 11 11.206 1.906 0.714 0.363 0.900 0.500 CA 1.397 11 residues pruned to eliminate duplicates Z: 15 18.628 1.788 0.422 0.919 1.000 0.857 CA 1.380 15 residues pruned to eliminate duplicates Z: 11 14.483 2.073 0.338 0.843 0.900 0.800 CB 1.365 11 residues pruned to eliminate duplicates Z: 12 14.410 2.229 0.274 0.767 0.818 0.545 CB 1.476 12 residues pruned to eliminate duplicates Z: 16 31.352 2.166 0.950 0.915 1.000 0.800 CA 1.354 16 residues pruned to eliminate duplicates Z: 88 62.283 2.193 0.878 0.627 0.931 0.632 CB 1.545 88 residues pruned to eliminate duplicates Z: 11 18.035 2.099 0.461 0.810 0.900 0.500 CB 1.577 11 residues pruned to eliminate duplicates Z: 11 13.573 1.951 0.448 0.854 0.900 0.700 CB 1.246 11 residues pruned to eliminate duplicates Z: 16 41.131 2.326 1.489 0.885 0.933 0.467 CB 1.420 16 residues pruned to eliminate duplicates Z: 87 66.149 2.188 0.956 0.642 0.942 0.674 CB 1.550 89 residues pruned to eliminate duplicates Z: 112 83.743 2.302 1.015 0.621 0.946 0.595 CB 1.617 112 residues pruned to eliminate duplicates Z: 18 28.380 1.904 1.042 0.913 0.882 0.647 CB 1.421 18 residues pruned to eliminate duplicates Z: 15 20.683 2.134 0.656 0.545 0.929 0.643 CA 1.613 15 residues pruned to eliminate duplicates Z: 16 28.724 2.016 0.834 0.885 1.000 0.733 CA 1.448 16 residues pruned to eliminate duplicates Z: 6 4.494 1.730 1.030 0.197 0.600 0.600 CB 1.368 6 residues pruned to eliminate duplicates Z: 16 33.397 2.143 0.976 0.932 0.933 0.867 CA 1.523 16 residues pruned to eliminate duplicates Z: 87 74.140 2.342 1.037 0.646 0.907 0.593 CB 1.611 87 residues pruned to eliminate duplicates Z: 15 43.803 2.141 1.511 0.941 1.000 0.643 CB 1.511 15 residues pruned to eliminate duplicates Z: 59 34.681 2.215 0.729 0.506 0.810 0.603 CB 1.459 59 residues pruned to eliminate duplicates Z: 18 24.483 1.951 0.686 0.873 0.941 0.765 CB 1.397 18 residues pruned to eliminate duplicates Z: 14 19.385 1.952 0.751 0.920 1.000 0.846 CB 1.108 14 residues pruned to eliminate duplicates Z: 9 19.089 2.038 0.819 0.855 1.000 0.750 CB 1.343 9 residues pruned to eliminate duplicates Z: 17 30.456 2.203 0.728 0.906 0.938 0.750 CB 1.518 17 residues pruned to eliminate duplicates Z: 14 17.717 2.205 0.625 0.376 0.923 0.538 CA 1.696 14 residues pruned to eliminate duplicates Z: 23 42.836 2.376 1.002 0.632 0.955 0.727 CA 1.777 23 residues pruned to eliminate duplicates Z: 10 14.812 1.903 0.705 0.842 0.889 0.667 CB 1.276 10 residues pruned to eliminate duplicates Z: 116 74.339 2.227 0.929 0.618 0.930 0.600 CB 1.551 116 residues pruned to eliminate duplicates Z: 9 14.804 2.048 0.812 0.799 0.750 0.625 CB 1.448 9 residues pruned to eliminate duplicates Z: 9 15.135 2.056 1.153 0.505 0.875 0.750 CB 1.375 9 residues pruned to eliminate duplicates Z: 12 28.448 2.249 0.911 0.920 0.909 0.818 CB 1.547 12 residues pruned to eliminate duplicates Z: 9 17.027 2.184 0.503 0.876 1.000 1.000 CB 1.333 9 residues pruned to eliminate duplicates Z: 13 24.673 1.999 0.762 0.931 1.000 0.917 CA 1.412 13 residues pruned to eliminate duplicates Z: 10 15.505 2.156 0.546 0.741 1.000 0.667 CB 1.249 10 residues pruned to eliminate duplicates Z: 11 20.749 1.892 0.945 0.812 1.000 0.800 CA 1.359 11 residues pruned to eliminate duplicates Z: 28 9.989 1.897 0.616 0.293 0.630 0.444 CB 1.256 28 residues pruned to eliminate duplicates Z: 7 4.323 1.901 -0.093 0.510 0.833 0.667 C 1.216 6 residues pruned to eliminate duplicates Z: 38 47.685 2.420 0.903 0.582 0.946 0.622 CB 1.664 38 residues pruned to eliminate duplicates Z: 35 48.287 2.367 1.055 0.621 0.941 0.706 CB 1.614 35 residues pruned to eliminate duplicates Z: 34 34.789 2.036 1.084 0.575 0.879 0.636 CB 1.510 34 residues pruned to eliminate duplicates Z: 16 33.694 2.053 0.992 0.904 1.000 0.533 CB 1.515 16 residues pruned to eliminate duplicates Z: 13 24.984 2.075 0.714 0.887 1.000 0.917 CA 1.462 13 residues pruned to eliminate duplicates Z: 10 10.445 1.701 0.358 0.769 1.000 0.556 CB 1.187 11 residues pruned to eliminate duplicates Z: 16 28.123 2.069 0.585 0.904 1.000 0.800 CB 1.577 16 residues pruned to eliminate duplicates Z: 16 27.796 2.128 0.775 0.896 1.000 0.800 CA 1.362 16 residues pruned to eliminate duplicates Z: 21 19.657 2.178 0.967 0.349 0.800 0.550 CA 1.511 21 residues pruned to eliminate duplicates Z: 10 15.020 1.907 0.527 0.873 1.000 0.778 CB 1.251 10 residues pruned to eliminate duplicates Z: 107 61.228 2.070 0.853 0.612 0.925 0.642 CB 1.507 104 residues pruned to eliminate duplicates Z: 145 73.385 2.098 0.899 0.611 0.924 0.597 CB 1.496 144 residues pruned to eliminate duplicates Z: 16 34.108 2.399 0.656 0.912 1.000 0.800 CB 1.571 16 residues pruned to eliminate duplicates Z: 11 12.849 1.602 0.954 0.752 0.900 0.800 CA 1.152 11 residues pruned to eliminate duplicates Z: 13 37.798 2.349 1.097 0.896 1.000 0.833 CA 1.586 13 residues pruned to eliminate duplicates Z: 123 75.061 2.124 0.997 0.599 0.918 0.598 CB 1.588 124 residues pruned to eliminate duplicates Z: 14 19.168 1.997 0.736 0.919 0.923 0.769 CB 1.170 14 residues pruned to eliminate duplicates Z: 16 33.703 2.028 1.124 0.902 1.000 0.933 CA 1.441 16 residues pruned to eliminate duplicates Z: 30 31.314 2.179 1.123 0.503 0.931 0.655 CB 1.346 30 residues pruned to eliminate duplicates Z: 15 7.810 1.918 0.403 0.427 0.857 0.429 CB 0.977 15 residues pruned to eliminate duplicates Z: 28 29.866 2.118 1.070 0.583 0.815 0.519 CB 1.485 28 residues pruned to eliminate duplicates Z: 75 69.020 2.371 0.984 0.603 0.905 0.649 CB 1.708 75 residues pruned to eliminate duplicates Z: 17 27.604 2.011 0.752 0.914 1.000 0.750 CA 1.385 17 residues pruned to eliminate duplicates Z: 15 32.435 2.256 0.795 0.936 1.000 0.929 CA 1.490 15 residues pruned to eliminate duplicates Z: 15 28.751 2.119 0.863 0.928 0.929 0.786 CA 1.468 15 residues pruned to eliminate duplicates Z: 15 24.491 2.081 0.964 0.875 0.857 0.429 CA 1.358 15 residues pruned to eliminate duplicates Z: 72 59.614 2.172 0.880 0.626 0.958 0.676 CB 1.607 72 residues pruned to eliminate duplicates Z: 14 35.379 2.365 0.891 0.843 0.923 0.769 CA 1.769 14 residues pruned to eliminate duplicates Z: 7 7.635 1.584 0.773 0.591 0.833 0.500 CA 1.221 Z: 17 20.308 1.984 0.526 0.614 0.938 0.625 CA 1.606 17 residues pruned to eliminate duplicates Z: 17 21.477 2.003 0.482 0.904 1.000 0.875 CA 1.288 17 residues pruned to eliminate duplicates Z: 8 11.212 2.174 0.573 0.459 0.857 0.571 CB 1.508 Z: 95 51.546 2.166 0.794 0.492 0.926 0.617 CB 1.489 95 residues pruned to eliminate duplicates Z: 16 22.869 2.071 0.861 0.850 0.933 0.600 CB 1.216 16 residues pruned to eliminate duplicates Z: 99 82.391 2.324 1.057 0.635 0.949 0.622 CB 1.617 99 residues pruned to eliminate duplicates Z: 16 32.794 2.053 0.971 0.906 1.000 0.867 CA 1.489 16 residues pruned to eliminate duplicates Z: 9 7.941 1.811 0.018 0.554 1.000 0.625 C 1.445 Z: 7 6.796 1.633 0.619 0.721 0.833 0.500 CA 1.032 7 residues pruned to eliminate duplicates Z: 15 17.193 2.097 0.662 0.491 0.857 0.429 CB 1.553 15 residues pruned to eliminate duplicates Z: 65 56.279 2.307 0.863 0.563 0.906 0.641 CB 1.698 65 residues pruned to eliminate duplicates Z: 36 42.220 2.319 0.956 0.572 0.886 0.629 CB 1.656 36 residues pruned to eliminate duplicates Z: 14 29.200 2.145 0.919 0.920 1.000 0.769 CB 1.386 14 residues pruned to eliminate duplicates Z: 87 65.233 2.147 0.990 0.648 0.930 0.674 CB 1.542 87 residues pruned to eliminate duplicates Z: 9 9.174 1.834 0.004 0.724 1.000 0.750 CB 1.439 Z: 18 17.825 2.258 0.557 0.343 0.941 0.529 CA 1.550 18 residues pruned to eliminate duplicates Z: 102 83.386 2.338 1.002 0.656 0.931 0.653 CB 1.647 102 residues pruned to eliminate duplicates Z: 20 9.490 1.842 0.498 0.376 0.737 0.526 CB 1.223 20 residues pruned to eliminate duplicates Z: 20 15.286 2.023 0.590 0.446 0.789 0.474 CB 1.460 20 residues pruned to eliminate duplicates Z: 70 65.206 2.297 0.894 0.688 0.913 0.565 CB 1.663 70 residues pruned to eliminate duplicates Z: 17 55.297 2.363 1.374 0.939 1.000 0.688 CB 1.713 17 residues pruned to eliminate duplicates Z: 9 21.383 2.169 0.553 0.897 1.000 0.750 CB 1.607 10 residues pruned to eliminate duplicates Z: 12 19.636 2.094 0.771 0.669 0.909 0.636 CB 1.502 12 residues pruned to eliminate duplicates Z: 16 30.271 2.047 0.955 0.897 0.933 0.800 CB 1.497 16 residues pruned to eliminate duplicates Z: 11 17.487 2.003 0.964 0.711 0.800 0.600 CA 1.451 11 residues pruned to eliminate duplicates Z: 17 16.562 1.877 0.527 0.572 0.938 0.562 CB 1.437 17 residues pruned to eliminate duplicates Z: 15 25.049 2.225 0.538 0.933 1.000 1.000 CA 1.365 15 residues pruned to eliminate duplicates Z: 14 35.072 2.191 1.060 0.938 1.000 0.692 CB 1.499 14 residues pruned to eliminate duplicates Z: 11 9.807 2.073 0.436 0.438 0.800 0.600 CA 1.389 11 residues pruned to eliminate duplicates Z: 7 7.982 1.782 0.210 0.588 1.000 0.333 C 1.389 7 residues pruned to eliminate duplicates Z: 17 24.693 2.000 0.900 0.909 0.938 0.750 CA 1.229 17 residues pruned to eliminate duplicates Z: 12 15.660 2.012 0.330 0.798 1.000 0.727 CB 1.359 12 residues pruned to eliminate duplicates Z: 63 52.474 2.093 1.038 0.659 0.903 0.645 CB 1.492 63 residues pruned to eliminate duplicates Z: 15 33.362 2.074 0.916 0.912 1.000 0.643 CB 1.589 15 residues pruned to eliminate duplicates Z: 14 17.540 1.921 0.844 0.612 1.000 0.692 CB 1.235 14 residues pruned to eliminate duplicates Z: 11 18.251 2.177 0.419 0.746 1.000 0.500 CB 1.500 11 residues pruned to eliminate duplicates Z: 56 53.479 2.263 0.963 0.645 0.909 0.600 CB 1.559 56 residues pruned to eliminate duplicates Z: 96 83.978 2.353 1.136 0.625 0.937 0.568 CB 1.627 96 residues pruned to eliminate duplicates Z: 10 10.793 1.797 0.369 0.876 0.889 0.667 CB 1.195 10 residues pruned to eliminate duplicates Z: 15 34.928 2.188 1.012 0.905 1.000 0.786 CA 1.509 15 residues pruned to eliminate duplicates Z: 10 8.098 1.811 0.481 0.435 0.889 0.667 CA 1.211 10 residues pruned to eliminate duplicates Z: 6 2.132 1.678 -0.053 0.462 0.800 0.800 CB 0.780 Z: 37 28.730 2.145 0.703 0.504 0.833 0.556 CB 1.567 37 residues pruned to eliminate duplicates Z: 31 52.887 2.383 1.125 0.643 0.933 0.700 CB 1.788 31 residues pruned to eliminate duplicates Z: 72 76.221 2.333 1.214 0.653 0.930 0.606 CB 1.633 72 residues pruned to eliminate duplicates Z: 17 11.673 1.842 0.397 0.558 0.875 0.562 CB 1.226 17 residues pruned to eliminate duplicates Z: 88 80.031 2.398 1.061 0.590 0.931 0.667 CB 1.710 88 residues pruned to eliminate duplicates Z: 15 27.566 2.164 0.903 0.912 1.000 0.643 CB 1.267 15 residues pruned to eliminate duplicates Z: 84 68.183 2.186 0.959 0.649 0.976 0.675 CB 1.558 84 residues pruned to eliminate duplicates Z: 14 27.445 2.067 0.622 0.894 1.000 0.923 CB 1.628 14 residues pruned to eliminate duplicates Z: 15 30.524 2.222 0.807 0.930 1.000 0.929 CB 1.421 15 residues pruned to eliminate duplicates Z: 12 19.930 2.148 0.563 0.795 0.909 0.727 CA 1.521 12 residues pruned to eliminate duplicates Z: 12 12.198 2.006 0.444 0.700 0.818 0.636 CB 1.293 12 residues pruned to eliminate duplicates Z: 55 40.701 2.167 0.839 0.445 0.907 0.574 CB 1.620 55 residues pruned to eliminate duplicates Z: 15 22.486 2.088 0.715 0.860 0.929 0.786 CB 1.329 15 residues pruned to eliminate duplicates Z: 12 9.528 1.791 0.783 0.304 0.818 0.545 CA 1.368 12 residues pruned to eliminate duplicates Z: 14 30.549 2.240 1.230 0.916 1.000 0.692 CB 1.198 14 residues pruned to eliminate duplicates Z: 12 18.683 2.218 0.635 0.750 0.818 0.636 CB 1.519 12 residues pruned to eliminate duplicates Z: 30 44.989 2.275 1.019 0.599 0.931 0.552 CA 1.778 30 residues pruned to eliminate duplicates Z: 7 7.792 1.558 0.945 0.664 1.000 0.833 CB 0.902 Z: 14 27.717 2.287 1.125 0.516 0.923 0.538 CB 1.686 14 residues pruned to eliminate duplicates Z: 10 18.024 1.784 0.988 0.869 1.000 0.889 CA 1.237 10 residues pruned to eliminate duplicates Z: 14 16.697 2.026 0.819 0.565 0.846 0.538 CA 1.394 14 residues pruned to eliminate duplicates Z: 8 13.618 1.906 0.431 0.924 1.000 1.000 CB 1.326 8 residues pruned to eliminate duplicates Z: 13 18.382 2.007 0.920 0.896 0.833 0.333 CB 1.183 13 residues pruned to eliminate duplicates Z: 16 20.524 1.951 0.392 0.910 1.000 0.733 CB 1.383 16 residues pruned to eliminate duplicates Z: 11 5.926 1.647 0.802 0.417 0.700 0.400 CB 0.984 11 residues pruned to eliminate duplicates Z: 10 12.656 1.587 0.825 0.763 1.000 0.667 CB 1.152 10 residues pruned to eliminate duplicates Z: 17 30.478 2.033 1.007 0.890 0.938 0.750 CA 1.433 17 residues pruned to eliminate duplicates Z: 10 20.351 2.071 0.599 0.915 1.000 0.556 CB 1.448 10 residues pruned to eliminate duplicates Z: 16 20.111 2.050 0.573 0.845 0.933 0.667 CB 1.283 16 residues pruned to eliminate duplicates Z: 10 15.774 2.175 0.454 0.859 0.889 0.667 CB 1.376 10 residues pruned to eliminate duplicates Z: 15 33.490 2.164 0.945 0.855 1.000 0.714 CA 1.570 15 residues pruned to eliminate duplicates Z: 11 7.352 1.702 0.089 0.715 1.000 0.600 CB 1.032 11 residues pruned to eliminate duplicates Z: 14 6.511 1.619 0.362 0.431 0.769 0.462 CB 1.143 Z: 58 67.862 2.317 1.093 0.685 0.947 0.649 CB 1.650 58 residues pruned to eliminate duplicates Z: 11 11.673 1.732 0.542 0.787 0.900 0.800 CA 1.193 11 residues pruned to eliminate duplicates Z: 13 31.120 2.149 1.463 0.746 0.917 0.917 CB 1.486 13 residues pruned to eliminate duplicates Z: 58 57.237 2.176 1.026 0.648 0.947 0.667 CB 1.580 58 residues pruned to eliminate duplicates Z: 11 15.099 1.751 0.756 0.818 1.000 0.600 CA 1.178 11 residues pruned to eliminate duplicates Z: 16 30.317 2.037 0.895 0.927 1.000 0.733 CB 1.421 16 residues pruned to eliminate duplicates Z: 31 18.947 2.022 0.746 0.335 0.833 0.400 CB 1.407 31 residues pruned to eliminate duplicates Z: 24 27.976 2.199 0.814 0.542 0.826 0.435 CB 1.698 24 residues pruned to eliminate duplicates Z: 18 26.452 1.950 0.789 0.885 1.000 0.824 CA 1.328 18 residues pruned to eliminate duplicates Z: 10 2.234 1.461 0.051 0.357 0.778 0.333 N 0.727 Z: 12 29.760 2.195 1.034 0.910 1.000 0.727 CB 1.425 12 residues pruned to eliminate duplicates Z: 10 7.706 1.467 0.306 0.864 1.000 0.667 CB 0.982 Z: 16 46.826 2.287 1.208 0.931 1.000 0.733 CB 1.674 16 residues pruned to eliminate duplicates Z: 7 4.133 1.912 0.122 0.497 0.667 0.500 CA 1.183 7 residues pruned to eliminate duplicates Z: 16 47.194 2.250 1.381 0.897 1.000 0.733 CB 1.628 16 residues pruned to eliminate duplicates Z: 15 20.489 1.940 0.641 0.919 1.000 0.929 CB 1.212 15 residues pruned to eliminate duplicates Z: 11 9.255 1.888 0.337 0.511 0.900 0.500 CB 1.274 11 residues pruned to eliminate duplicates Z: 8 3.788 1.386 0.575 0.398 0.714 0.429 N 1.022 8 residues pruned to eliminate duplicates Z: 11 9.207 1.955 0.629 0.477 0.700 0.700 CA 1.337 11 residues pruned to eliminate duplicates Z: 120 91.650 2.332 1.026 0.632 0.958 0.647 CB 1.641 120 residues pruned to eliminate duplicates Z: 10 15.475 1.797 0.937 0.792 1.000 0.778 CB 1.147 10 residues pruned to eliminate duplicates Z: 15 34.511 2.099 1.005 0.935 1.000 0.643 CB 1.527 15 residues pruned to eliminate duplicates Z: 74 56.077 2.133 0.858 0.623 0.959 0.671 CB 1.537 74 residues pruned to eliminate duplicates Z: 91 63.269 2.153 0.936 0.622 0.922 0.556 CB 1.547 91 residues pruned to eliminate duplicates Z: 18 26.937 1.956 0.726 0.900 1.000 0.882 CB 1.382 18 residues pruned to eliminate duplicates Z: 9 26.133 2.213 1.108 0.849 1.000 0.500 CA 1.468 9 residues pruned to eliminate duplicates Z: 16 36.456 2.131 1.010 0.945 1.000 1.000 CA 1.521 16 residues pruned to eliminate duplicates Z: 94 79.287 2.369 1.076 0.602 0.892 0.581 CB 1.700 94 residues pruned to eliminate duplicates Z: 37 36.756 2.044 1.069 0.603 0.917 0.639 CB 1.432 37 residues pruned to eliminate duplicates Z: 10 8.719 1.741 0.133 0.611 1.000 0.778 CB 1.327 9 residues pruned to eliminate duplicates Z: 47 51.749 2.364 0.915 0.587 0.891 0.543 CA 1.739 47 residues pruned to eliminate duplicates Z: 17 46.913 2.286 1.091 0.939 1.000 0.938 CA 1.705 17 residues pruned to eliminate duplicates Z: 7 8.737 1.736 0.470 0.842 0.833 0.667 C 1.250 7 residues pruned to eliminate duplicates Z: 7 8.064 1.889 -0.156 0.806 1.000 0.833 CB 1.581 6 residues pruned to eliminate duplicates Z: 152 77.778 2.121 0.890 0.595 0.947 0.596 CB 1.523 162 residues pruned to eliminate duplicates Z: 41 52.829 2.300 1.272 0.633 0.875 0.650 CB 1.613 41 residues pruned to eliminate duplicates Z: 15 27.152 1.912 1.029 0.898 1.000 0.643 CB 1.339 15 residues pruned to eliminate duplicates Z: 10 4.266 1.775 0.193 0.251 0.667 0.556 CB 1.341 10 residues pruned to eliminate duplicates Z: 70 41.310 2.038 0.669 0.604 0.957 0.551 CB 1.384 70 residues pruned to eliminate duplicates Z: 10 4.309 1.440 0.762 0.368 0.556 0.333 CB 1.174 10 residues pruned to eliminate duplicates Z: 8 2.396 1.794 -0.166 0.264 0.714 0.429 CB 1.109 Z: 10 9.875 1.828 0.361 0.751 0.778 0.556 CA 1.360 10 residues pruned to eliminate duplicates Z: 13 28.951 2.113 0.844 0.870 1.000 0.750 CB 1.565 13 residues pruned to eliminate duplicates Z: 54 45.687 2.072 1.042 0.616 0.943 0.604 CB 1.408 54 residues pruned to eliminate duplicates Z: 17 26.215 2.015 0.842 0.892 0.938 0.875 CA 1.354 17 residues pruned to eliminate duplicates Z: 16 15.760 2.163 0.556 0.501 0.867 0.533 CA 1.393 16 residues pruned to eliminate duplicates Z: 8 7.939 1.647 0.511 0.577 0.857 0.857 CA 1.305 10 residues pruned to eliminate duplicates Z: 11 19.166 1.948 0.821 0.825 1.000 0.800 CA 1.290 11 residues pruned to eliminate duplicates Z: 125 82.943 2.298 1.046 0.544 0.927 0.581 CB 1.637 124 residues pruned to eliminate duplicates Z: 88 77.112 2.391 0.971 0.608 0.931 0.678 CB 1.700 88 residues pruned to eliminate duplicates Z: 15 35.208 2.178 1.129 0.902 1.000 0.571 CA 1.447 15 residues pruned to eliminate duplicates Z: 56 35.785 2.213 0.577 0.550 0.945 0.564 CB 1.393 56 residues pruned to eliminate duplicates Z: 18 27.823 1.936 1.053 0.860 0.882 0.706 CA 1.415 18 residues pruned to eliminate duplicates Z: 18 16.565 1.915 0.417 0.584 0.941 0.647 CB 1.452 18 residues pruned to eliminate duplicates Z: 120 78.200 2.134 1.057 0.649 0.950 0.689 CB 1.497 120 residues pruned to eliminate duplicates Z: 10 14.316 1.730 0.901 0.889 0.889 0.667 CB 1.175 10 residues pruned to eliminate duplicates Z: 7 2.577 1.734 0.713 0.494 0.833 0.500 CB 0.428 Z: 9 10.831 1.665 0.360 0.809 1.000 0.750 CA 1.291 11 residues pruned to eliminate duplicates Z: 16 18.729 1.992 1.030 0.841 0.867 0.533 CB 1.030 16 residues pruned to eliminate duplicates Z: 10 23.210 2.075 0.750 0.932 1.000 0.889 CB 1.487 10 residues pruned to eliminate duplicates Z: 12 24.579 1.903 1.069 0.788 1.000 0.636 CB 1.462 12 residues pruned to eliminate duplicates Z: 34 23.319 2.138 0.595 0.404 0.909 0.576 CB 1.449 34 residues pruned to eliminate duplicates Z: 15 28.021 2.084 1.000 0.898 0.929 0.786 CA 1.384 15 residues pruned to eliminate duplicates Z: 9 25.489 2.306 0.700 0.899 1.000 0.875 CB 1.642 9 residues pruned to eliminate duplicates Z: 60 62.279 2.325 1.155 0.620 0.898 0.542 CB 1.609 60 residues pruned to eliminate duplicates Z: 38 23.923 1.982 0.641 0.408 0.892 0.595 CB 1.493 36 residues pruned to eliminate duplicates Z: 18 23.570 1.940 0.660 0.852 0.941 0.529 CB 1.395 18 residues pruned to eliminate duplicates Z: 16 28.212 2.068 0.970 0.866 0.933 0.733 CA 1.402 16 residues pruned to eliminate duplicates Z: 17 15.223 1.696 0.430 0.810 0.938 0.750 CA 1.278 17 residues pruned to eliminate duplicates Z: 44 44.036 2.206 1.042 0.619 0.884 0.605 CB 1.507 44 residues pruned to eliminate duplicates Z: 9 11.968 1.832 0.552 0.788 0.875 0.500 CB 1.320 9 residues pruned to eliminate duplicates Z: 9 10.540 1.711 0.541 0.834 0.875 0.625 CB 1.211 9 residues pruned to eliminate duplicates Z: 9 23.048 2.277 0.685 0.896 1.000 0.875 CB 1.521 9 residues pruned to eliminate duplicates Z: 6 6.141 1.264 0.926 0.822 1.000 0.400 N 0.853 6 residues pruned to eliminate duplicates Z: 15 23.465 2.154 0.336 0.922 1.000 0.857 CB 1.532 15 residues pruned to eliminate duplicates Z: 9 10.846 1.870 0.096 0.828 1.000 1.000 CA 1.409 10 residues pruned to eliminate duplicates Z: 19 18.387 2.108 0.495 0.496 0.889 0.722 CB 1.554 19 residues pruned to eliminate duplicates Z: 7 9.305 1.948 0.457 0.565 0.833 0.667 CA 1.508 7 residues pruned to eliminate duplicates Z: 9 8.655 1.762 0.074 0.892 1.000 0.750 CB 1.162 9 residues pruned to eliminate duplicates Z: 17 28.596 2.010 0.813 0.896 1.000 0.875 CA 1.405 17 residues pruned to eliminate duplicates Z: 21 26.987 2.166 0.980 0.547 0.950 0.600 CB 1.415 21 residues pruned to eliminate duplicates Z: 10 12.573 2.037 0.807 0.649 0.778 0.778 CB 1.274 10 residues pruned to eliminate duplicates Z: 18 17.446 1.853 0.487 0.806 0.882 0.824 CB 1.333 18 residues pruned to eliminate duplicates Z: 11 23.047 2.067 0.681 0.907 1.000 0.300 CB 1.490 11 residues pruned to eliminate duplicates Z: 14 8.829 1.710 0.679 0.591 0.846 0.615 CB 0.923 9 residues pruned to eliminate duplicates Z: 28 15.700 1.821 0.418 0.521 0.889 0.630 CB 1.289 28 residues pruned to eliminate duplicates Z: 60 56.077 2.343 0.961 0.570 0.898 0.678 CB 1.654 60 residues pruned to eliminate duplicates Z: 86 77.594 2.294 1.105 0.627 0.941 0.635 CB 1.643 86 residues pruned to eliminate duplicates Z: 6 4.915 1.972 -0.374 0.634 1.000 0.800 CB 1.569 7 residues pruned to eliminate duplicates Z: 11 14.463 1.662 0.756 0.788 1.000 0.700 CB 1.216 11 residues pruned to eliminate duplicates Z: 14 47.697 2.373 1.251 0.896 1.000 0.769 CA 1.774 14 residues pruned to eliminate duplicates Z: 8 6.887 1.629 0.590 0.595 0.714 0.714 CB 1.284 8 residues pruned to eliminate duplicates Z: 11 23.031 1.939 1.099 0.817 0.900 0.600 CB 1.509 11 residues pruned to eliminate duplicates Z: 11 14.974 1.993 0.353 0.851 1.000 0.600 CB 1.300 11 residues pruned to eliminate duplicates Z: 83 71.180 2.313 0.973 0.619 0.951 0.610 CB 1.618 83 residues pruned to eliminate duplicates Z: 15 24.299 2.079 0.567 0.835 0.929 0.571 CB 1.608 15 residues pruned to eliminate duplicates Z: 12 33.412 2.213 1.057 0.863 1.000 0.818 CB 1.624 12 residues pruned to eliminate duplicates Z: 71 66.278 2.265 0.995 0.667 0.900 0.586 CB 1.669 71 residues pruned to eliminate duplicates Z: 15 29.937 2.296 0.566 0.918 0.929 0.929 CA 1.689 15 residues pruned to eliminate duplicates Z: 87 61.159 2.163 0.895 0.637 0.919 0.616 CB 1.540 87 residues pruned to eliminate duplicates Z: 11 14.913 1.802 0.771 0.740 0.900 0.800 CA 1.324 11 residues pruned to eliminate duplicates Z: 106 79.531 2.296 1.090 0.649 0.895 0.552 CB 1.572 106 residues pruned to eliminate duplicates Z: 15 38.388 2.211 1.100 0.925 1.000 0.857 CA 1.551 15 residues pruned to eliminate duplicates Z: 12 18.051 2.015 0.587 0.851 1.000 0.636 CB 1.260 12 residues pruned to eliminate duplicates Z: 9 11.656 1.899 0.393 0.911 1.000 0.750 CB 1.104 9 residues pruned to eliminate duplicates Z: 26 14.593 2.014 0.616 0.405 0.800 0.520 CB 1.239 26 residues pruned to eliminate duplicates Z: 19 9.400 1.920 0.482 0.342 0.722 0.500 CB 1.279 19 residues pruned to eliminate duplicates Z: 16 18.060 1.701 0.701 0.850 0.933 0.667 CB 1.278 16 residues pruned to eliminate duplicates Z: 10 12.007 2.005 0.641 0.469 0.889 0.778 CB 1.412 10 residues pruned to eliminate duplicates Z: 17 51.057 2.409 1.207 0.921 1.000 0.688 CB 1.690 17 residues pruned to eliminate duplicates Z: 16 27.323 2.055 0.869 0.892 0.933 0.333 CA 1.414 16 residues pruned to eliminate duplicates Z: 15 13.355 1.814 0.195 0.870 0.929 0.857 CB 1.294 15 residues pruned to eliminate duplicates Z: 9 19.992 2.041 1.186 0.875 0.875 0.625 CB 1.317 9 residues pruned to eliminate duplicates Z: 9 8.522 1.699 0.126 0.773 1.000 0.625 CA 1.236 8 residues pruned to eliminate duplicates Z: 13 20.212 2.127 0.926 0.621 1.000 0.917 CB 1.270 22 residues pruned to eliminate duplicates Z: 16 27.531 2.021 0.947 0.929 0.867 0.600 CB 1.458 16 residues pruned to eliminate duplicates Z: 17 35.029 2.260 0.836 0.903 0.938 0.625 CB 1.604 17 residues pruned to eliminate duplicates Z: 16 34.956 2.065 1.158 0.917 0.933 0.467 CB 1.531 16 residues pruned to eliminate duplicates Z: 11 13.129 1.707 0.642 0.892 1.000 0.700 CB 1.065 11 residues pruned to eliminate duplicates Z: 8 7.926 1.593 0.720 0.601 0.714 0.571 CB 1.390 8 residues pruned to eliminate duplicates Z: 98 56.039 2.065 0.935 0.581 0.907 0.649 CB 1.453 98 residues pruned to eliminate duplicates Z: 7 2.696 1.535 0.133 0.321 0.667 0.500 C 1.157 Z: 9 19.702 2.235 0.615 0.900 1.000 0.625 CB 1.379 9 residues pruned to eliminate duplicates Z: 67 67.593 2.300 1.012 0.652 0.939 0.712 CB 1.661 67 residues pruned to eliminate duplicates Z: 93 77.159 2.297 1.089 0.624 0.913 0.685 CB 1.634 93 residues pruned to eliminate duplicates Z: 16 29.953 2.296 0.656 0.891 0.933 0.933 CB 1.567 16 residues pruned to eliminate duplicates Z: 6 7.773 1.752 0.552 0.644 1.000 0.600 CB 1.117 Z: 79 69.410 2.287 0.994 0.647 0.923 0.641 CB 1.628 79 residues pruned to eliminate duplicates Z: 54 64.500 2.358 1.052 0.625 0.962 0.736 CB 1.691 54 residues pruned to eliminate duplicates Z: 10 10.124 1.730 0.449 0.844 0.889 0.889 CB 1.127 10 residues pruned to eliminate duplicates Z: 7 5.694 1.537 0.627 0.488 0.833 0.333 C 1.128 7 residues pruned to eliminate duplicates Z: 15 20.444 2.192 0.414 0.872 0.929 0.857 CA 1.384 15 residues pruned to eliminate duplicates Z: 9 13.699 2.164 0.469 0.845 0.875 0.500 CB 1.295 9 residues pruned to eliminate duplicates Z: 14 19.448 2.273 0.662 0.444 1.000 0.846 CB 1.512 14 residues pruned to eliminate duplicates Z: 31 35.133 2.416 0.787 0.553 0.900 0.600 CB 1.568 31 residues pruned to eliminate duplicates Z: 38 54.077 2.297 1.088 0.717 0.892 0.703 CB 1.708 38 residues pruned to eliminate duplicates Z: 11 11.418 1.844 0.288 0.842 1.000 0.600 CB 1.132 11 residues pruned to eliminate duplicates Z: 15 31.076 2.096 0.847 0.907 1.000 0.643 CB 1.525 15 residues pruned to eliminate duplicates Z: 8 5.971 1.868 -0.219 0.705 0.857 0.571 N 1.498 Z: 41 23.321 1.898 0.557 0.505 0.925 0.575 CB 1.341 41 residues pruned to eliminate duplicates Z: 16 32.830 2.111 0.919 0.899 1.000 0.733 CA 1.496 16 residues pruned to eliminate duplicates Z: 33 50.848 2.331 1.182 0.672 0.969 0.719 CB 1.557 33 residues pruned to eliminate duplicates Z: 10 4.543 1.757 -0.115 0.431 1.000 0.333 CB 1.046 10 residues pruned to eliminate duplicates Z: 11 12.636 1.743 0.608 0.717 0.900 0.800 CA 1.302 11 residues pruned to eliminate duplicates Z: 11 11.307 1.943 0.703 0.460 1.000 0.400 CB 1.126 Z: 122 71.866 2.111 0.979 0.621 0.950 0.595 CB 1.467 122 residues pruned to eliminate duplicates Z: 78 60.732 2.385 0.896 0.525 0.883 0.571 CB 1.691 78 residues pruned to eliminate duplicates Z: 88 57.452 2.315 0.863 0.475 0.862 0.575 CB 1.699 88 residues pruned to eliminate duplicates Z: 68 54.431 2.142 0.932 0.636 0.940 0.627 CB 1.505 68 residues pruned to eliminate duplicates Z: 70 56.186 2.180 0.916 0.620 0.913 0.594 CB 1.583 70 residues pruned to eliminate duplicates Z: 13 24.359 2.456 0.670 0.632 0.917 0.500 CB 1.653 13 residues pruned to eliminate duplicates Z: 31 30.968 2.173 0.730 0.569 0.933 0.700 CB 1.507 31 residues pruned to eliminate duplicates Z: 6 11.315 1.956 0.468 0.798 1.000 0.800 CA 1.357 6 residues pruned to eliminate duplicates Z: 11 7.189 1.744 0.430 0.275 0.800 0.700 CB 1.470 11 residues pruned to eliminate duplicates Z: 29 23.820 2.090 0.822 0.325 0.964 0.643 CB 1.486 29 residues pruned to eliminate duplicates Z: 6 2.232 1.629 -0.152 0.359 0.800 0.400 N 1.051 Z: 10 25.396 2.123 0.726 0.874 1.000 0.667 CB 1.682 10 residues pruned to eliminate duplicates Z: 144 88.688 2.300 1.016 0.589 0.909 0.608 CB 1.615 144 residues pruned to eliminate duplicates Z: 15 16.391 1.775 0.328 0.909 1.000 0.929 CA 1.318 15 residues pruned to eliminate duplicates Z: 7 8.216 1.910 0.463 0.503 0.833 0.833 CB 1.437 7 residues pruned to eliminate duplicates Z: 6 3.677 1.673 -0.178 0.647 0.800 0.600 CB 1.304 2 residues pruned to eliminate duplicates Z: 91 79.968 2.366 1.068 0.638 0.900 0.689 CB 1.683 91 residues pruned to eliminate duplicates Z: 16 14.148 2.130 0.639 0.365 0.800 0.533 CA 1.512 16 residues pruned to eliminate duplicates Z: 10 15.322 2.005 0.650 0.813 0.889 0.667 CA 1.322 10 residues pruned to eliminate duplicates Z: 8 4.219 1.623 0.139 0.760 0.571 0.286 CB 1.198 8 residues pruned to eliminate duplicates Z: 18 13.419 1.908 0.788 0.313 0.824 0.529 CB 1.425 18 residues pruned to eliminate duplicates Z: 61 71.260 2.397 1.136 0.614 0.917 0.567 CB 1.759 61 residues pruned to eliminate duplicates Z: 13 32.565 2.099 1.211 0.934 0.917 0.917 CB 1.541 13 residues pruned to eliminate duplicates Z: 10 14.098 1.788 0.498 0.810 1.000 0.556 CA 1.340 10 residues pruned to eliminate duplicates Z: 23 38.208 2.357 0.907 0.570 0.955 0.636 CA 1.775 23 residues pruned to eliminate duplicates Z: 19 15.107 2.041 0.674 0.517 0.833 0.389 CB 1.230 19 residues pruned to eliminate duplicates Z: 25 21.915 2.105 0.737 0.401 0.875 0.708 CA 1.552 25 residues pruned to eliminate duplicates Z: 6 4.302 1.254 0.291 0.703 1.000 0.600 C 0.988 6 residues pruned to eliminate duplicates Z: 15 36.395 2.277 0.943 0.893 0.929 0.643 CB 1.700 15 residues pruned to eliminate duplicates Z: 13 23.359 2.180 0.820 0.660 0.917 0.750 CB 1.597 12 residues pruned to eliminate duplicates Z: 8 16.039 1.983 0.852 0.802 0.857 0.571 CB 1.480 Z: 58 41.684 2.063 0.977 0.600 0.895 0.596 CB 1.376 58 residues pruned to eliminate duplicates Z: 13 27.099 2.072 0.749 0.913 1.000 1.000 CA 1.528 13 residues pruned to eliminate duplicates Z: 8 9.580 1.949 0.766 0.456 0.857 0.429 CA 1.284 8 residues pruned to eliminate duplicates Z: 8 3.314 1.406 0.591 0.582 0.714 0.714 CB 0.725 8 residues pruned to eliminate duplicates Z: 14 26.320 1.945 0.892 0.826 1.000 0.615 CB 1.495 14 residues pruned to eliminate duplicates Z: 6 6.011 1.836 0.119 0.414 1.000 0.800 N 1.431 6 residues pruned to eliminate duplicates Z: 83 68.209 2.193 0.991 0.664 0.939 0.695 CB 1.579 83 residues pruned to eliminate duplicates Z: 72 65.655 2.320 0.939 0.611 0.930 0.704 CB 1.677 72 residues pruned to eliminate duplicates Z: 139 95.324 2.280 1.036 0.658 0.957 0.667 CB 1.579 139 residues pruned to eliminate duplicates Z: 6 2.143 1.396 -0.237 0.660 0.800 0.800 N 0.971 7 residues pruned to eliminate duplicates Z: 15 28.092 2.220 0.627 0.925 1.000 0.929 CA 1.458 15 residues pruned to eliminate duplicates Z: 68 66.922 2.291 0.966 0.631 0.955 0.716 CB 1.680 68 residues pruned to eliminate duplicates Z: 94 59.876 2.330 0.836 0.519 0.903 0.559 CB 1.578 94 residues pruned to eliminate duplicates Z: 8 3.630 1.475 0.354 0.314 0.714 0.714 C 1.181 Z: 13 7.064 1.774 0.261 0.214 0.917 0.333 CB 1.393 13 residues pruned to eliminate duplicates Z: 137 83.540 2.286 0.947 0.595 0.919 0.581 CB 1.600 137 residues pruned to eliminate duplicates Z: 8 4.298 1.967 0.782 0.323 0.571 0.571 CB 0.985 8 residues pruned to eliminate duplicates Z: 29 27.016 2.210 0.726 0.505 0.929 0.643 CB 1.435 29 residues pruned to eliminate duplicates Z: 115 73.847 2.133 0.982 0.613 0.939 0.614 CB 1.567 115 residues pruned to eliminate duplicates Z: 178 101.891 2.326 0.987 0.588 0.932 0.621 CB 1.634 178 residues pruned to eliminate duplicates Z: 14 18.565 1.989 0.554 0.898 1.000 0.923 CB 1.192 14 residues pruned to eliminate duplicates Z: 16 33.562 2.057 1.121 0.931 1.000 1.000 CA 1.387 16 residues pruned to eliminate duplicates 11 1.471 1.499 -0.008 0.301 0.800 0.400 CB 0.488 ? Z: 92 72.996 2.422 0.873 0.594 0.890 0.604 CB 1.732 92 residues pruned to eliminate duplicates Z: 11 4.766 1.598 0.264 0.207 0.900 0.300 CB 1.172 Z: 60 55.453 2.147 1.058 0.681 0.932 0.712 CB 1.484 60 residues pruned to eliminate duplicates Z: 15 36.916 2.423 0.960 0.897 0.929 0.571 CB 1.602 15 residues pruned to eliminate duplicates Z: 120 73.751 2.327 0.893 0.567 0.916 0.672 CB 1.570 120 residues pruned to eliminate duplicates Z: 29 37.861 2.359 1.096 0.539 0.857 0.500 CB 1.625 29 residues pruned to eliminate duplicates Z: 11 13.519 2.002 0.356 0.742 0.900 0.500 CB 1.409 11 residues pruned to eliminate duplicates Z: 91 80.269 2.312 0.996 0.652 0.944 0.678 CB 1.685 103 residues pruned to eliminate duplicates Z: 17 8.034 1.797 0.503 0.550 0.812 0.625 CB 0.871 7 residues pruned to eliminate duplicates Z: 15 20.049 2.084 0.965 0.568 0.786 0.643 CA 1.559 15 residues pruned to eliminate duplicates Z: 12 8.704 1.588 0.744 0.430 0.818 0.636 CB 1.246 12 residues pruned to eliminate duplicates Z: 6 3.113 1.484 0.204 0.291 0.800 0.600 C 1.232 Z: 7 2.012 1.702 -0.152 0.245 0.833 0.333 CB 0.916 3 residues pruned to eliminate duplicates Z: 16 24.310 2.103 0.705 0.876 1.000 0.867 CB 1.272 16 residues pruned to eliminate duplicates Z: 50 62.844 2.484 0.905 0.621 0.959 0.694 CB 1.764 50 residues pruned to eliminate duplicates Z: 17 17.397 1.933 0.304 0.878 1.000 0.875 CB 1.253 17 residues pruned to eliminate duplicates Z: 9 23.927 2.307 0.691 0.923 1.000 1.000 CB 1.524 9 residues pruned to eliminate duplicates Z: 15 13.351 1.822 0.763 0.575 0.786 0.714 CB 1.315 15 residues pruned to eliminate duplicates Z: 37 22.084 1.988 0.650 0.385 0.861 0.639 CB 1.473 37 residues pruned to eliminate duplicates Z: 6 2.793 1.130 0.190 0.778 1.000 0.800 O 0.726 6 residues pruned to eliminate duplicates Z: 11 6.881 1.651 0.266 0.609 0.900 0.600 CB 1.042 Z: 8 8.912 2.185 0.237 0.760 0.714 0.571 CB 1.384 8 residues pruned to eliminate duplicates Z: 18 33.326 1.940 1.070 0.908 1.000 0.706 CA 1.429 18 residues pruned to eliminate duplicates Z: 12 7.724 1.592 0.334 0.569 0.909 0.818 CB 1.128 7 residues pruned to eliminate duplicates Z: 55 45.596 2.267 0.822 0.587 0.944 0.685 CB 1.463 55 residues pruned to eliminate duplicates Z: 60 57.426 2.342 0.942 0.580 0.915 0.644 CB 1.663 60 residues pruned to eliminate duplicates Z: 10 18.401 2.133 0.770 0.790 0.889 0.556 CA 1.416 10 residues pruned to eliminate duplicates Z: 84 76.124 2.327 1.003 0.666 0.928 0.675 CB 1.657 84 residues pruned to eliminate duplicates Z: 8 6.705 1.641 0.438 0.473 1.000 0.571 CB 1.104 7 residues pruned to eliminate duplicates Z: 7 3.950 1.586 -0.023 0.427 1.000 0.333 CB 1.123 Z: 33 24.525 1.908 0.663 0.528 0.938 0.594 CB 1.418 33 residues pruned to eliminate duplicates Z: 6 2.299 1.580 -0.044 0.481 1.000 0.600 CB 0.694 Z: 10 16.600 2.207 0.455 0.595 1.000 0.667 CA 1.573 10 residues pruned to eliminate duplicates Z: 10 21.928 2.041 1.032 0.904 0.889 0.556 CB 1.412 10 residues pruned to eliminate duplicates Z: 87 65.015 2.179 0.844 0.644 0.965 0.674 CB 1.580 87 residues pruned to eliminate duplicates 6 1.121 1.511 0.215 0.281 0.400 0.400 CA 0.873 ? Z: 6 9.800 1.635 0.784 0.846 1.000 1.000 CB 1.116 6 1.359 1.726 0.019 0.304 0.600 0.400 CB 0.716 ? Z: 30 58.059 2.476 1.282 0.657 0.931 0.724 CB 1.772 30 residues pruned to eliminate duplicates Z: 87 61.966 2.175 0.885 0.648 0.907 0.593 CB 1.566 87 residues pruned to eliminate duplicates Z: 13 23.104 2.043 0.955 0.671 1.000 0.500 CA 1.426 13 residues pruned to eliminate duplicates Z: 50 50.628 2.193 0.945 0.604 0.939 0.653 CA 1.636 50 residues pruned to eliminate duplicates Z: 7 6.915 1.784 0.158 0.725 1.000 0.833 CB 1.116 7 residues pruned to eliminate duplicates Z: 83 69.008 2.287 1.001 0.661 0.878 0.634 CB 1.633 83 residues pruned to eliminate duplicates Z: 19 12.450 1.976 0.354 0.342 0.778 0.444 CB 1.675 19 residues pruned to eliminate duplicates Z: 8 3.886 1.478 0.545 0.333 0.714 0.286 N 1.080 Z: 47 42.164 2.035 0.815 0.651 0.957 0.696 CB 1.529 47 residues pruned to eliminate duplicates Z: 9 9.340 1.503 0.463 0.820 1.000 0.625 CB 1.138 9 residues pruned to eliminate duplicates Z: 65 35.593 2.024 0.737 0.458 0.906 0.625 CB 1.458 65 residues pruned to eliminate duplicates Z: 11 14.731 2.098 0.556 0.570 0.900 0.800 CB 1.482 11 residues pruned to eliminate duplicates Z: 10 7.533 1.535 0.171 0.753 1.000 0.556 CB 1.114 10 residues pruned to eliminate duplicates Z: 85 76.159 2.282 1.026 0.670 0.940 0.655 CB 1.633 85 residues pruned to eliminate duplicates Z: 15 21.663 2.133 0.411 0.935 1.000 0.929 CA 1.341 15 residues pruned to eliminate duplicates Z: 57 68.375 2.347 1.197 0.627 0.929 0.589 CB 1.694 57 residues pruned to eliminate duplicates Z: 13 29.832 2.126 0.985 0.937 1.000 0.917 CA 1.421 13 residues pruned to eliminate duplicates Z: 46 48.261 2.273 1.003 0.580 0.911 0.533 CB 1.606 46 residues pruned to eliminate duplicates Z: 10 6.147 1.748 0.634 0.387 0.778 0.556 CB 1.040 Z: 9 3.565 1.604 -0.266 0.582 0.875 0.625 CB 1.131 Z: 80 69.378 2.321 1.073 0.585 0.899 0.519 CB 1.664 80 residues pruned to eliminate duplicates Z: 9 5.267 1.764 -0.107 0.555 0.875 0.625 N 1.280 7 residues pruned to eliminate duplicates Z: 6 3.402 1.776 0.191 0.385 1.000 1.000 CB 0.813 Z: 14 31.168 2.097 1.030 0.863 1.000 0.769 CA 1.489 14 residues pruned to eliminate duplicates Z: 15 25.016 1.907 0.951 0.852 0.857 0.357 CA 1.551 15 residues pruned to eliminate duplicates Z: 9 4.137 1.471 -0.222 0.829 0.875 0.750 CB 1.099 9 residues pruned to eliminate duplicates Z: 83 77.458 2.340 1.054 0.635 0.939 0.671 CB 1.670 83 residues pruned to eliminate duplicates Z: 13 45.038 2.411 1.285 0.926 0.917 0.833 CA 1.805 13 residues pruned to eliminate duplicates Z: 33 22.899 1.947 0.569 0.594 0.875 0.719 CB 1.384 33 residues pruned to eliminate duplicates Z: 10 22.738 2.227 0.560 0.885 1.000 0.778 CB 1.575 10 residues pruned to eliminate duplicates 7 1.902 1.531 -0.281 0.300 1.000 0.500 O 0.882 ? Z: 26 33.669 2.034 1.177 0.633 0.920 0.560 CB 1.459 26 residues pruned to eliminate duplicates Z: 9 4.092 1.698 -0.109 0.350 0.875 0.375 C 1.286 9 residues pruned to eliminate duplicates Z: 6 8.995 1.871 0.561 0.596 0.800 0.800 CA 1.572 6 residues pruned to eliminate duplicates Z: 9 15.014 1.953 0.508 0.849 0.875 0.875 CA 1.527 9 residues pruned to eliminate duplicates Z: 29 22.984 2.117 0.906 0.402 0.821 0.500 CA 1.454 29 residues pruned to eliminate duplicates Z: 122 76.153 2.147 0.947 0.620 0.950 0.645 CB 1.555 122 residues pruned to eliminate duplicates Z: 21 27.830 2.106 1.111 0.624 0.900 0.600 CB 1.383 21 residues pruned to eliminate duplicates Z: 11 13.926 1.898 0.783 0.571 1.000 0.600 CB 1.215 9 residues pruned to eliminate duplicates Z: 41 21.983 1.899 0.494 0.484 0.875 0.625 CB 1.423 41 residues pruned to eliminate duplicates Z: 18 16.003 1.971 0.496 0.395 0.941 0.588 CA 1.562 18 residues pruned to eliminate duplicates Z: 8 6.258 1.646 -0.095 0.650 1.000 0.714 O 1.381 Z: 9 23.043 2.188 0.996 0.757 1.000 0.500 CB 1.484 9 residues pruned to eliminate duplicates Z: 7 3.127 1.757 -0.217 0.388 1.000 0.667 N 1.045 Z: 17 55.935 2.292 1.512 0.926 1.000 0.750 CB 1.703 17 residues pruned to eliminate duplicates Z: 7 6.934 1.864 0.763 0.740 1.000 0.833 CB 0.695 Z: 18 11.204 1.882 0.429 0.499 0.765 0.471 N 1.322 18 residues pruned to eliminate duplicates Z: 43 28.464 2.053 0.804 0.417 0.881 0.595 CB 1.467 71 residues pruned to eliminate duplicates Z: 9 10.381 1.903 0.094 0.822 1.000 0.875 CA 1.334 Z: 7 10.916 1.872 0.439 0.782 1.000 1.000 CB 1.291 7 residues pruned to eliminate duplicates Z: 14 6.013 1.491 0.089 0.539 0.846 0.538 CB 1.169 5 residues pruned to eliminate duplicates Z: 27 34.783 2.183 0.908 0.513 1.000 0.692 CB 1.616 27 residues pruned to eliminate duplicates Z: 145 92.196 2.327 0.974 0.611 0.931 0.611 CB 1.617 145 residues pruned to eliminate duplicates Z: 27 31.308 2.348 1.042 0.494 0.846 0.615 CB 1.523 27 residues pruned to eliminate duplicates Z: 16 39.711 2.253 1.042 0.929 0.933 0.667 CA 1.671 16 residues pruned to eliminate duplicates Z: 89 68.426 2.230 0.972 0.642 0.943 0.625 CB 1.540 89 residues pruned to eliminate duplicates Z: 74 61.860 2.293 1.000 0.537 0.932 0.603 CB 1.634 74 residues pruned to eliminate duplicates Z: 9 6.435 1.613 0.641 0.571 0.875 0.750 CB 0.917 5 residues pruned to eliminate duplicates Z: 48 42.532 2.033 0.952 0.651 0.957 0.638 CB 1.419 48 residues pruned to eliminate duplicates Z: 11 13.156 1.630 0.758 0.777 1.000 0.700 CB 1.137 11 residues pruned to eliminate duplicates 7 1.922 1.780 0.069 0.358 0.500 0.333 CB 0.961 ? Z: 36 36.006 2.222 0.999 0.485 0.886 0.571 CB 1.570 36 residues pruned to eliminate duplicates Z: 13 15.703 2.036 0.691 0.414 0.917 0.500 CA 1.572 13 residues pruned to eliminate duplicates Z: 11 20.642 2.035 0.724 0.887 1.000 0.800 CB 1.341 11 residues pruned to eliminate duplicates Z: 6 6.385 1.726 0.101 0.630 1.000 0.800 CB 1.330 6 residues pruned to eliminate duplicates Z: 12 8.433 1.623 0.583 0.551 0.818 0.818 CB 1.150 11 residues pruned to eliminate duplicates Z: 70 61.021 2.230 0.887 0.643 0.942 0.652 CB 1.621 70 residues pruned to eliminate duplicates Z: 26 15.418 1.941 0.608 0.439 0.760 0.600 CA 1.385 26 residues pruned to eliminate duplicates Z: 17 35.692 2.243 0.971 0.873 0.938 0.500 CA 1.568 17 residues pruned to eliminate duplicates Z: 55 34.394 1.984 0.725 0.635 0.944 0.667 CB 1.276 55 residues pruned to eliminate duplicates Z: 81 53.431 2.142 0.749 0.609 0.938 0.575 CB 1.533 81 residues pruned to eliminate duplicates Z: 15 23.764 1.911 0.932 0.923 1.000 0.786 CB 1.209 15 residues pruned to eliminate duplicates Z: 34 33.253 2.189 0.611 0.566 0.939 0.576 CB 1.639 34 residues pruned to eliminate duplicates 6 1.857 1.412 0.510 0.100 0.600 0.200 O 1.082 ? Z: 152 73.731 2.102 0.891 0.602 0.914 0.616 CB 1.498 152 residues pruned to eliminate duplicates Z: 7 5.907 1.678 0.025 0.680 0.833 0.667 CB 1.426 Z: 14 5.786 1.627 0.241 0.404 0.923 0.385 CB 0.952 7 residues pruned to eliminate duplicates Z: 10 17.394 1.983 0.766 0.894 0.889 0.667 CB 1.336 10 residues pruned to eliminate duplicates Z: 130 82.125 2.356 0.981 0.546 0.907 0.612 CB 1.634 130 residues pruned to eliminate duplicates Z: 54 63.010 2.273 1.121 0.676 0.962 0.736 CB 1.587 54 residues pruned to eliminate duplicates Z: 9 5.833 1.804 0.837 0.307 0.750 0.625 CA 1.028 9 residues pruned to eliminate duplicates Z: 145 95.776 2.285 1.043 0.612 0.965 0.667 CB 1.594 145 residues pruned to eliminate duplicates Z: 6 5.798 1.677 0.511 0.542 0.800 0.800 CB 1.228 Z: 43 40.777 2.171 0.707 0.621 0.976 0.690 CB 1.551 43 residues pruned to eliminate duplicates Z: 14 18.700 1.881 0.768 0.883 0.923 0.692 CB 1.222 14 residues pruned to eliminate duplicates Z: 21 19.868 2.210 0.688 0.427 0.900 0.450 CB 1.427 21 residues pruned to eliminate duplicates Z: 8 13.990 1.907 0.580 0.868 1.000 0.429 CB 1.283 8 residues pruned to eliminate duplicates Z: 23 23.049 2.174 0.738 0.516 0.864 0.591 CB 1.482 23 residues pruned to eliminate duplicates Z: 12 10.625 2.011 0.474 0.533 0.727 0.545 CA 1.438 12 residues pruned to eliminate duplicates Z: 61 57.029 2.372 1.042 0.574 0.883 0.500 CB 1.602 61 residues pruned to eliminate duplicates Z: 12 28.688 2.353 1.020 0.862 0.818 0.545 CB 1.633 12 residues pruned to eliminate duplicates Z: 46 25.697 1.925 0.599 0.486 0.933 0.533 CB 1.352 46 residues pruned to eliminate duplicates Z: 31 24.192 2.052 0.663 0.512 0.867 0.600 CB 1.477 31 residues pruned to eliminate duplicates Z: 10 19.622 2.035 0.764 0.830 0.889 0.333 CB 1.541 10 residues pruned to eliminate duplicates Z: 7 2.700 1.537 0.550 0.470 0.500 0.333 CB 0.954 Z: 7 4.079 1.684 0.109 0.247 0.833 0.667 CA 1.433 Z: 31 38.055 2.257 0.978 0.577 0.867 0.567 CA 1.669 31 residues pruned to eliminate duplicates Z: 32 27.472 2.124 0.954 0.468 0.871 0.581 CB 1.410 32 residues pruned to eliminate duplicates Z: 40 27.815 2.177 0.694 0.442 0.872 0.538 CB 1.471 40 residues pruned to eliminate duplicates Z: 9 6.542 1.711 0.242 0.883 1.000 1.000 CB 0.787 9 residues pruned to eliminate duplicates Z: 26 33.445 2.315 0.909 0.493 0.960 0.600 CB 1.588 26 residues pruned to eliminate duplicates Z: 7 4.194 1.359 0.502 0.379 0.833 0.333 C 1.145 Z: 13 10.594 1.964 -0.026 0.784 1.000 0.750 CB 1.244 13 residues pruned to eliminate duplicates Z: 40 28.564 2.159 0.848 0.428 0.897 0.487 CB 1.376 40 residues pruned to eliminate duplicates Z: 61 51.564 2.168 0.966 0.657 0.917 0.683 CB 1.473 61 residues pruned to eliminate duplicates Z: 6 2.960 1.550 0.236 0.594 0.800 0.600 C 0.790 Z: 9 10.634 1.878 0.696 0.277 1.000 0.625 CB 1.518 9 residues pruned to eliminate duplicates Z: 10 9.046 1.790 0.627 0.340 0.889 0.444 CA 1.387 10 residues pruned to eliminate duplicates Z: 14 34.052 2.092 0.951 0.941 1.000 0.615 CB 1.606 14 residues pruned to eliminate duplicates Z: 8 5.923 1.773 0.763 0.621 0.857 0.429 CB 0.745 Z: 9 3.796 1.450 0.538 0.282 0.875 0.500 C 0.880 9 residues pruned to eliminate duplicates Z: 13 38.079 2.337 1.335 0.906 0.917 0.583 CA 1.563 13 residues pruned to eliminate duplicates 6 1.788 1.503 0.642 0.100 0.600 0.200 C 0.900 ? Z: 40 24.538 2.037 0.621 0.400 0.872 0.538 CB 1.517 40 residues pruned to eliminate duplicates Z: 62 51.659 2.123 0.983 0.599 0.918 0.607 CB 1.557 62 residues pruned to eliminate duplicates Z: 24 22.851 2.104 0.927 0.470 0.913 0.696 CB 1.327 24 residues pruned to eliminate duplicates Z: 8 20.483 2.069 0.994 0.824 1.000 0.857 CB 1.417 8 residues pruned to eliminate duplicates Z: 8 6.237 1.563 0.041 0.807 1.000 0.571 CB 1.109 8 residues pruned to eliminate duplicates Z: 6 5.551 2.245 0.409 0.167 0.800 0.200 CA 1.470 6 residues pruned to eliminate duplicates Z: 12 14.253 2.185 0.576 0.314 1.000 0.364 CA 1.534 12 residues pruned to eliminate duplicates Z: 145 80.932 2.119 0.929 0.622 0.958 0.674 CB 1.535 145 residues pruned to eliminate duplicates Z: 10 3.736 1.942 0.007 0.210 0.667 0.444 CA 1.345 10 residues pruned to eliminate duplicates Z: 6 3.977 1.724 -0.071 0.304 1.000 0.600 C 1.381 Z: 9 18.857 2.042 0.534 0.913 1.000 0.625 CB 1.506 8 residues pruned to eliminate duplicates Z: 20 14.261 1.869 0.711 0.300 0.842 0.474 CB 1.519 20 residues pruned to eliminate duplicates Z: 31 23.373 1.860 0.906 0.478 0.867 0.500 CB 1.419 31 residues pruned to eliminate duplicates Z: 9 4.756 1.651 0.252 0.741 0.875 0.375 CB 0.749 Z: 12 18.981 2.146 0.942 0.598 0.909 0.727 CB 1.377 12 residues pruned to eliminate duplicates Z: 80 60.105 2.200 0.931 0.607 0.962 0.608 CB 1.495 80 residues pruned to eliminate duplicates Z: 20 9.377 1.532 0.505 0.506 0.842 0.579 CB 1.102 18 residues pruned to eliminate duplicates Z: 6 2.602 1.744 0.204 0.568 0.800 0.800 CB 0.648 Z: 18 17.127 2.002 0.383 0.543 0.941 0.588 CB 1.529 18 residues pruned to eliminate duplicates Z: 43 48.028 2.258 0.919 0.731 0.905 0.643 CB 1.535 43 residues pruned to eliminate duplicates Z: 18 31.362 1.949 1.211 0.883 0.941 0.588 CA 1.357 18 residues pruned to eliminate duplicates Z: 75 59.385 2.284 0.933 0.559 0.919 0.622 CB 1.607 75 residues pruned to eliminate duplicates Z: 6 2.387 1.377 0.010 0.736 1.000 0.400 CB 0.621 Z: 72 59.327 2.194 1.022 0.666 0.901 0.648 CB 1.511 72 residues pruned to eliminate duplicates Z: 10 5.997 1.414 0.456 0.823 0.889 0.444 CB 0.826 10 residues pruned to eliminate duplicates Z: 44 44.138 2.248 0.767 0.670 0.953 0.651 CB 1.519 44 residues pruned to eliminate duplicates 7 1.340 1.632 -0.369 0.448 0.833 0.500 CB 0.673 ? Z: 53 49.770 2.192 0.843 0.640 0.942 0.673 CB 1.590 53 residues pruned to eliminate duplicates Z: 9 3.241 1.284 0.552 0.186 0.875 0.625 CB 0.958 Z: 28 39.672 2.159 1.169 0.588 0.963 0.630 CB 1.557 28 residues pruned to eliminate duplicates Z: 27 30.768 2.252 0.812 0.578 0.962 0.654 CB 1.427 27 residues pruned to eliminate duplicates Z: 7 5.568 1.853 -0.157 0.530 1.000 0.500 CB 1.412 7 residues pruned to eliminate duplicates Z: 8 2.684 1.500 0.300 0.191 0.714 0.571 CB 1.054 Z: 10 8.304 1.461 0.420 0.702 1.000 0.444 CB 1.110 8 residues pruned to eliminate duplicates Z: 7 5.943 1.553 0.727 0.680 0.833 0.833 CB 0.920 7 residues pruned to eliminate duplicates Z: 74 69.002 2.331 1.008 0.652 0.918 0.685 CB 1.632 74 residues pruned to eliminate duplicates Z: 11 6.725 1.518 0.561 0.364 0.900 0.400 CB 1.154 Z: 9 7.910 1.616 0.615 0.728 0.750 0.500 CB 1.163 9 residues pruned to eliminate duplicates Z: 19 15.234 1.914 0.551 0.531 0.889 0.611 CB 1.320 19 residues pruned to eliminate duplicates Z: 8 14.779 2.055 0.805 0.866 0.857 0.571 CB 1.286 8 residues pruned to eliminate duplicates Z: 31 60.828 2.454 1.236 0.684 0.933 0.767 CA 1.832 31 residues pruned to eliminate duplicates Z: 9 12.209 1.943 0.429 0.630 0.875 0.625 CB 1.572 9 residues pruned to eliminate duplicates Z: 10 12.786 1.676 0.653 0.841 1.000 1.000 CB 1.147 10 residues pruned to eliminate duplicates Z: 29 28.013 2.281 0.826 0.358 0.893 0.643 CA 1.659 29 residues pruned to eliminate duplicates Z: 15 31.724 2.041 1.091 0.922 1.000 0.786 CB 1.397 15 residues pruned to eliminate duplicates Z: 8 9.833 1.751 0.199 0.783 1.000 0.857 CB 1.380 8 residues pruned to eliminate duplicates Z: 42 50.154 2.299 1.210 0.514 0.927 0.463 CB 1.640 42 residues pruned to eliminate duplicates Z: 18 26.955 2.007 0.744 0.840 0.941 0.588 CB 1.481 18 residues pruned to eliminate duplicates Z: 25 15.807 1.901 0.341 0.612 0.833 0.667 CB 1.365 25 residues pruned to eliminate duplicates Z: 12 45.331 2.535 1.316 0.894 0.909 0.455 CA 1.837 12 residues pruned to eliminate duplicates Z: 21 23.288 2.043 0.836 0.527 0.900 0.550 CB 1.501 21 residues pruned to eliminate duplicates 6 1.981 1.574 -0.061 0.427 0.600 0.600 CB 1.078 ? Z: 37 33.775 2.020 0.977 0.594 0.889 0.611 CB 1.449 37 residues pruned to eliminate duplicates Z: 38 36.236 2.215 0.817 0.555 0.919 0.514 CB 1.526 38 residues pruned to eliminate duplicates Z: 121 89.217 2.370 1.016 0.618 0.917 0.617 CB 1.662 121 residues pruned to eliminate duplicates Z: 50 33.413 1.988 0.719 0.633 0.918 0.612 CB 1.342 50 residues pruned to eliminate duplicates Z: 21 21.202 2.113 0.800 0.420 0.850 0.700 CA 1.594 21 residues pruned to eliminate duplicates Z: 39 50.121 2.318 1.025 0.587 0.947 0.632 CB 1.681 39 residues pruned to eliminate duplicates Z: 45 44.743 2.151 0.926 0.667 0.977 0.659 CB 1.428 45 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 10 14.750 1.804 0.568 0.885 1.000 1.000 CB 1.255 10 residues pruned to eliminate duplicates Z: 10 14.225 1.743 0.586 0.895 1.000 1.000 CB 1.229 10 residues pruned to eliminate duplicates Z: 13 11.336 1.627 0.680 0.614 0.917 0.667 CB 1.173 11 residues pruned to eliminate duplicates Z: 9 12.475 1.910 0.469 0.910 1.000 0.875 CB 1.115 9 residues pruned to eliminate duplicates Z: 11 12.483 1.790 0.543 0.739 0.900 0.800 CB 1.282 11 residues pruned to eliminate duplicates Z: 10 16.862 1.853 0.670 0.818 1.000 0.889 CB 1.378 10 residues pruned to eliminate duplicates Z: 10 13.411 1.795 0.769 0.806 0.889 0.667 CB 1.213 10 residues pruned to eliminate duplicates Z: 18 15.470 1.895 0.582 0.532 0.824 0.529 CB 1.473 11 residues pruned to eliminate duplicates Z: 9 11.841 1.885 0.206 0.807 1.000 0.875 CB 1.409 9 residues pruned to eliminate duplicates Z: 19 14.213 1.938 0.352 0.470 0.833 0.500 CB 1.582 19 residues pruned to eliminate duplicates Z: 17 20.723 2.002 0.607 0.532 0.938 0.500 CB 1.664 17 residues pruned to eliminate duplicates Z: 10 10.360 1.857 0.231 0.741 1.000 0.667 CB 1.218 10 residues pruned to eliminate duplicates Z: 17 20.801 2.001 0.577 0.589 0.938 0.438 CB 1.613 17 residues pruned to eliminate duplicates Z: 9 13.112 1.796 0.466 0.701 1.000 0.500 CB 1.465 9 residues pruned to eliminate duplicates Z: 10 12.801 1.938 0.358 0.623 1.000 0.778 CB 1.443 10 residues pruned to eliminate duplicates Z: 20 16.975 1.901 0.575 0.448 0.947 0.579 CB 1.448 20 residues pruned to eliminate duplicates Z: 18 16.771 2.025 0.419 0.466 1.000 0.588 CB 1.467 18 residues pruned to eliminate duplicates Z: 18 17.246 1.999 0.560 0.455 1.000 0.353 CB 1.404 19 residues pruned to eliminate duplicates Z: 7 7.927 2.192 0.286 0.480 0.833 0.667 CA 1.405 7 residues pruned to eliminate duplicates Z: 82 58.401 2.283 0.893 0.506 0.889 0.593 CB 1.678 82 residues pruned to eliminate duplicates Z: 28 20.019 1.990 0.811 0.347 0.889 0.593 CA 1.420 28 residues pruned to eliminate duplicates Z: 19 15.537 2.188 0.681 0.337 0.833 0.389 CA 1.427 19 residues pruned to eliminate duplicates Z: 49 24.728 2.026 0.578 0.380 0.854 0.438 CB 1.486 66 residues pruned to eliminate duplicates Z: 53 24.128 1.985 0.659 0.361 0.827 0.481 CB 1.427 53 residues pruned to eliminate duplicates Z: 114 74.512 2.294 0.970 0.535 0.912 0.593 CB 1.645 300 residues pruned to eliminate duplicates Z: 70 37.575 2.176 0.715 0.418 0.870 0.435 CB 1.518 70 residues pruned to eliminate duplicates Z: 37 24.566 1.998 0.686 0.399 0.889 0.583 CA 1.522 Z: 6 6.167 1.626 0.666 0.461 1.000 0.400 CA 1.060 6 residues pruned to eliminate duplicates Z: 12 12.788 2.026 1.052 0.326 0.727 0.545 CB 1.543 11 residues pruned to eliminate duplicates Z: 10 9.408 1.705 0.772 0.427 1.000 0.444 CA 1.120 5 residues pruned to eliminate duplicates Z: 8 11.236 1.805 0.812 0.555 1.000 0.571 CB 1.230 8 residues pruned to eliminate duplicates Z: 7 9.477 1.908 0.700 0.589 0.833 0.833 CA 1.314 7 residues pruned to eliminate duplicates Z: 62 60.805 2.340 0.991 0.591 0.902 0.574 CB 1.700 11 residues pruned to eliminate duplicates Z: 9 12.668 1.949 0.777 0.498 0.875 0.625 CB 1.481 9 residues pruned to eliminate duplicates Z: 144 88.189 2.286 0.912 0.614 0.944 0.622 CB 1.605 59 residues pruned to eliminate duplicates Z: 17 36.188 2.314 1.122 0.768 0.875 0.562 CB 1.661 17 residues pruned to eliminate duplicates Z: 144 92.641 2.318 0.944 0.624 0.944 0.657 CB 1.620 145 residues pruned to eliminate duplicates Z: 26 36.092 2.337 0.868 0.564 0.960 0.680 CA 1.619 26 residues pruned to eliminate duplicates Z: 115 81.239 2.330 1.000 0.572 0.904 0.623 CB 1.685 115 residues pruned to eliminate duplicates Z: 60 64.245 2.360 0.932 0.580 0.983 0.610 CB 1.728 60 residues pruned to eliminate duplicates Z: 142 93.892 2.309 0.991 0.630 0.950 0.674 CB 1.602 142 residues pruned to eliminate duplicates Z: 59 67.901 2.359 1.056 0.608 0.948 0.603 CB 1.751 59 residues pruned to eliminate duplicates Z: 89 83.493 2.414 1.063 0.613 0.932 0.648 CB 1.723 89 residues pruned to eliminate duplicates Z: 59 63.844 2.369 0.988 0.613 0.966 0.621 CB 1.657 59 residues pruned to eliminate duplicates Z: 67 60.520 2.299 1.009 0.573 0.924 0.606 CB 1.627 67 residues pruned to eliminate duplicates Z: 61 64.953 2.343 1.033 0.595 0.967 0.667 CB 1.663 61 residues pruned to eliminate duplicates Z: 142 94.660 2.320 0.998 0.613 0.950 0.631 CB 1.626 142 residues pruned to eliminate duplicates Z: 94 83.288 2.379 1.065 0.631 0.903 0.613 CB 1.721 94 residues pruned to eliminate duplicates Z: 87 83.772 2.423 1.095 0.607 0.930 0.663 CB 1.729 87 residues pruned to eliminate duplicates Z: 140 93.323 2.304 0.986 0.615 0.950 0.626 CB 1.634 140 residues pruned to eliminate duplicates Z: 81 61.673 2.270 0.956 0.528 0.925 0.588 CB 1.634 81 residues pruned to eliminate duplicates Z: 58 67.858 2.404 1.070 0.603 0.947 0.667 CB 1.729 58 residues pruned to eliminate duplicates Z: 93 81.210 2.379 1.022 0.618 0.924 0.620 CB 1.704 93 residues pruned to eliminate duplicates Z: 65 63.583 2.301 1.025 0.582 0.938 0.641 CB 1.682 65 residues pruned to eliminate duplicates Z: 59 63.987 2.368 1.030 0.595 0.931 0.638 CB 1.714 59 residues pruned to eliminate duplicates Z: 144 86.427 2.287 0.949 0.599 0.937 0.685 CB 1.575 144 residues pruned to eliminate duplicates Z: 59 62.732 2.365 1.044 0.598 0.914 0.586 CB 1.698 59 residues pruned to eliminate duplicates Z: 60 61.484 2.350 1.043 0.584 0.932 0.644 CB 1.650 60 residues pruned to eliminate duplicates Z: 144 90.786 2.299 1.014 0.599 0.930 0.636 CB 1.603 144 residues pruned to eliminate duplicates Z: 99 71.672 2.285 0.983 0.566 0.939 0.653 CB 1.598 99 residues pruned to eliminate duplicates Z: 62 57.401 2.328 0.961 0.581 0.902 0.623 CB 1.652 62 residues pruned to eliminate duplicates Z: 58 62.040 2.372 1.062 0.595 0.912 0.649 CB 1.682 58 residues pruned to eliminate duplicates Z: 67 52.981 2.246 0.954 0.543 0.909 0.591 CB 1.567 67 residues pruned to eliminate duplicates Z: 98 76.704 2.335 1.027 0.597 0.887 0.598 CB 1.691 98 residues pruned to eliminate duplicates Z: 38 50.606 2.383 1.189 0.584 0.892 0.622 CB 1.650 38 residues pruned to eliminate duplicates Z: 96 74.092 2.299 0.938 0.599 0.947 0.621 CB 1.638 96 residues pruned to eliminate duplicates Z: 143 94.294 2.314 0.962 0.622 0.958 0.683 CB 1.622 143 residues pruned to eliminate duplicates Z: 105 82.497 2.374 1.070 0.563 0.933 0.663 CB 1.661 105 residues pruned to eliminate duplicates Z: 66 61.097 2.314 1.015 0.561 0.892 0.554 CB 1.717 66 residues pruned to eliminate duplicates Z: 114 72.153 2.224 0.952 0.596 0.920 0.664 CB 1.551 114 residues pruned to eliminate duplicates Z: 59 65.105 2.388 1.057 0.583 0.948 0.586 CB 1.694 59 residues pruned to eliminate duplicates Z: 59 64.450 2.365 1.068 0.578 0.948 0.724 CB 1.692 59 residues pruned to eliminate duplicates Z: 63 54.337 2.304 0.930 0.555 0.887 0.613 CB 1.658 63 residues pruned to eliminate duplicates Z: 95 80.061 2.370 1.031 0.616 0.915 0.649 CB 1.680 95 residues pruned to eliminate duplicates Z: 28 40.472 2.234 1.116 0.659 0.889 0.481 CB 1.599 28 residues pruned to eliminate duplicates Z: 130 82.216 2.310 1.006 0.559 0.899 0.597 CB 1.641 130 residues pruned to eliminate duplicates Z: 140 88.985 2.303 0.975 0.627 0.921 0.655 CB 1.598 140 residues pruned to eliminate duplicates Z: 58 64.464 2.338 1.051 0.592 0.965 0.649 CB 1.691 58 residues pruned to eliminate duplicates Z: 118 79.250 2.310 1.014 0.574 0.880 0.624 CB 1.665 118 residues pruned to eliminate duplicates Z: 70 66.640 2.260 1.134 0.630 0.913 0.623 CB 1.612 70 residues pruned to eliminate duplicates Z: 59 57.811 2.353 0.941 0.564 0.914 0.603 CB 1.709 59 residues pruned to eliminate duplicates Z: 120 83.875 2.299 1.065 0.577 0.941 0.563 CB 1.598 120 residues pruned to eliminate duplicates Z: 79 74.952 2.409 1.065 0.584 0.910 0.577 CB 1.730 79 residues pruned to eliminate duplicates Z: 102 80.126 2.314 1.101 0.619 0.931 0.604 CB 1.574 102 residues pruned to eliminate duplicates Z: 100 78.989 2.316 1.114 0.608 0.929 0.636 CB 1.575 100 residues pruned to eliminate duplicates Z: 103 74.129 2.283 0.977 0.626 0.912 0.598 CB 1.584 103 residues pruned to eliminate duplicates Z: 112 77.943 2.276 0.896 0.629 0.955 0.658 CB 1.591 92 residues pruned to eliminate duplicates Z: 62 60.418 2.332 0.965 0.615 0.918 0.689 CB 1.650 62 residues pruned to eliminate duplicates Z: 101 83.308 2.334 1.126 0.622 0.920 0.660 CB 1.626 42 residues pruned to eliminate duplicates Z: 101 78.026 2.326 1.041 0.616 0.920 0.570 CB 1.601 101 residues pruned to eliminate duplicates Z: 120 85.469 2.297 1.042 0.637 0.933 0.639 CB 1.576 120 residues pruned to eliminate duplicates Z: 112 84.238 2.299 1.077 0.638 0.919 0.568 CB 1.601 114 residues pruned to eliminate duplicates Z: 82 61.183 2.231 0.949 0.656 0.889 0.605 CB 1.521 82 residues pruned to eliminate duplicates Z: 93 79.606 2.372 1.043 0.590 0.924 0.652 CB 1.701 93 residues pruned to eliminate duplicates Z: 89 58.831 2.178 0.903 0.557 0.932 0.602 CB 1.537 89 residues pruned to eliminate duplicates Z: 95 53.585 2.166 0.801 0.573 0.915 0.553 CB 1.444 95 residues pruned to eliminate duplicates Z: 31 52.251 2.441 1.039 0.667 0.933 0.767 CA 1.760 31 residues pruned to eliminate duplicates Z: 47 43.299 2.220 1.029 0.598 0.826 0.543 CB 1.563 47 residues pruned to eliminate duplicates Z: 87 80.765 2.416 1.077 0.624 0.919 0.628 CB 1.681 87 residues pruned to eliminate duplicates Z: 89 59.630 2.155 0.909 0.583 0.932 0.602 CB 1.531 89 residues pruned to eliminate duplicates Z: 41 47.399 2.252 1.024 0.637 0.900 0.550 CB 1.606 41 residues pruned to eliminate duplicates Z: 40 42.147 2.298 1.017 0.622 0.821 0.462 CB 1.581 40 residues pruned to eliminate duplicates Z: 90 59.049 2.181 0.915 0.611 0.921 0.584 CB 1.464 90 residues pruned to eliminate duplicates Z: 102 80.155 2.320 1.097 0.600 0.901 0.574 CB 1.654 102 residues pruned to eliminate duplicates Z: 70 69.831 2.271 1.180 0.643 0.942 0.580 CB 1.577 70 residues pruned to eliminate duplicates Z: 84 63.356 2.190 0.963 0.643 0.928 0.627 CB 1.526 84 residues pruned to eliminate duplicates Z: 150 95.736 2.286 1.045 0.627 0.953 0.631 CB 1.563 150 residues pruned to eliminate duplicates Z: 139 89.866 2.296 1.038 0.619 0.942 0.572 CB 1.551 139 residues pruned to eliminate duplicates Z: 47 51.033 2.204 1.133 0.632 0.913 0.630 CB 1.549 47 residues pruned to eliminate duplicates Z: 76 66.282 2.287 1.137 0.618 0.893 0.600 CB 1.569 76 residues pruned to eliminate duplicates Z: 97 82.599 2.355 1.157 0.616 0.906 0.604 CB 1.641 97 residues pruned to eliminate duplicates Z: 38 56.885 2.380 1.096 0.678 0.919 0.622 CB 1.732 38 residues pruned to eliminate duplicates Z: 43 53.791 2.254 1.099 0.665 0.976 0.643 CB 1.542 43 residues pruned to eliminate duplicates Z: 144 88.148 2.282 0.998 0.607 0.923 0.622 CB 1.582 144 residues pruned to eliminate duplicates Z: 100 86.143 2.343 1.108 0.630 0.949 0.636 CB 1.634 100 residues pruned to eliminate duplicates Z: 97 85.416 2.337 1.132 0.606 0.938 0.604 CB 1.688 97 residues pruned to eliminate duplicates Z: 96 89.017 2.373 1.149 0.632 0.937 0.589 CB 1.688 96 residues pruned to eliminate duplicates Z: 100 84.088 2.337 1.148 0.613 0.939 0.616 CB 1.610 100 residues pruned to eliminate duplicates Z: 40 57.007 2.340 1.176 0.656 0.897 0.744 CB 1.728 40 residues pruned to eliminate duplicates Z: 45 42.488 2.171 0.985 0.592 0.909 0.545 CB 1.496 45 residues pruned to eliminate duplicates Z: 99 74.956 2.296 0.980 0.597 0.918 0.612 CB 1.653 99 residues pruned to eliminate duplicates Z: 137 94.193 2.309 1.027 0.620 0.949 0.654 CB 1.624 135 residues pruned to eliminate duplicates Z: 89 65.382 2.219 0.990 0.620 0.920 0.648 CB 1.531 89 residues pruned to eliminate duplicates Z: 85 66.945 2.235 0.952 0.641 0.940 0.643 CB 1.561 85 residues pruned to eliminate duplicates Z: 46 51.588 2.205 1.106 0.656 0.933 0.733 CB 1.534 46 residues pruned to eliminate duplicates Z: 10 4.165 1.520 0.385 0.452 0.778 0.333 CB 0.890 10 residues pruned to eliminate duplicates Z: 138 93.209 2.303 1.049 0.619 0.942 0.664 CB 1.601 138 residues pruned to eliminate duplicates Z: 136 97.756 2.320 1.047 0.634 0.970 0.681 CB 1.610 138 residues pruned to eliminate duplicates Z: 69 51.633 2.158 0.954 0.607 0.897 0.632 CB 1.496 69 residues pruned to eliminate duplicates Z: 47 43.224 2.180 0.924 0.671 0.935 0.630 CB 1.388 47 residues pruned to eliminate duplicates Z: 73 53.234 2.114 0.920 0.609 0.944 0.639 CB 1.476 73 residues pruned to eliminate duplicates Z: 123 82.708 2.245 1.036 0.613 0.918 0.623 CB 1.604 123 residues pruned to eliminate duplicates Z: 44 40.669 2.146 0.804 0.644 0.977 0.651 CB 1.434 44 residues pruned to eliminate duplicates Z: 57 58.440 2.214 1.009 0.698 0.982 0.750 CB 1.492 57 residues pruned to eliminate duplicates Z: 75 65.859 2.238 0.937 0.645 0.973 0.662 CB 1.584 75 residues pruned to eliminate duplicates Z: 89 65.572 2.229 1.039 0.623 0.909 0.614 CB 1.507 89 residues pruned to eliminate duplicates Z: 87 69.438 2.228 1.028 0.634 0.942 0.698 CB 1.552 87 residues pruned to eliminate duplicates Z: 94 61.166 2.209 0.930 0.581 0.935 0.602 CB 1.472 94 residues pruned to eliminate duplicates Z: 75 68.896 2.254 1.016 0.662 0.973 0.703 CB 1.558 75 residues pruned to eliminate duplicates Z: 49 42.166 2.137 0.816 0.604 0.979 0.583 CB 1.451 49 residues pruned to eliminate duplicates Z: 80 65.403 2.249 0.937 0.646 0.949 0.722 CB 1.553 80 residues pruned to eliminate duplicates Z: 112 80.464 2.268 1.068 0.630 0.937 0.604 CB 1.539 112 residues pruned to eliminate duplicates Z: 35 26.654 2.027 0.740 0.592 0.882 0.559 CB 1.345 35 residues pruned to eliminate duplicates Z: 133 93.678 2.298 1.049 0.656 0.932 0.652 CB 1.607 133 residues pruned to eliminate duplicates Z: 48 38.292 2.166 0.799 0.585 0.915 0.681 CB 1.444 48 residues pruned to eliminate duplicates Z: 89 69.787 2.219 1.029 0.629 0.955 0.659 CB 1.533 89 residues pruned to eliminate duplicates Z: 88 66.893 2.229 1.050 0.615 0.931 0.598 CB 1.512 88 residues pruned to eliminate duplicates Z: 87 74.234 2.265 0.972 0.623 0.988 0.651 CB 1.614 87 residues pruned to eliminate duplicates Z: 70 62.142 2.240 1.029 0.654 0.913 0.652 CB 1.561 70 residues pruned to eliminate duplicates Z: 110 78.069 2.246 1.040 0.647 0.936 0.651 CB 1.521 110 residues pruned to eliminate duplicates Z: 77 70.052 2.211 1.097 0.649 0.961 0.684 CB 1.570 77 residues pruned to eliminate duplicates Z: 144 99.634 2.307 1.094 0.630 0.958 0.587 CB 1.593 144 residues pruned to eliminate duplicates Z: 125 80.745 2.240 1.013 0.605 0.935 0.669 CB 1.556 125 residues pruned to eliminate duplicates Z: 111 80.883 2.249 1.046 0.640 0.945 0.673 CB 1.555 111 residues pruned to eliminate duplicates Z: 86 68.468 2.260 1.031 0.638 0.918 0.671 CB 1.550 86 residues pruned to eliminate duplicates Z: 80 72.669 2.276 1.072 0.672 0.937 0.671 CB 1.580 80 residues pruned to eliminate duplicates Z: 52 41.320 2.125 0.777 0.651 0.961 0.608 CB 1.385 52 residues pruned to eliminate duplicates Z: 18 17.080 2.172 0.659 0.400 0.824 0.471 CB 1.551 18 residues pruned to eliminate duplicates Z: 143 89.620 2.301 1.003 0.618 0.923 0.662 CB 1.582 143 residues pruned to eliminate duplicates Z: 18 22.689 2.254 0.747 0.475 0.941 0.588 CB 1.522 18 residues pruned to eliminate duplicates Z: 18 20.382 2.274 0.753 0.469 0.882 0.471 CB 1.451 18 residues pruned to eliminate duplicates Z: 18 18.335 2.205 0.718 0.418 0.882 0.588 CB 1.450 18 residues pruned to eliminate duplicates Z: 26 16.084 1.969 0.384 0.511 0.920 0.480 CB 1.270 26 residues pruned to eliminate duplicates Z: 44 40.342 2.176 0.858 0.640 0.930 0.721 CB 1.435 44 residues pruned to eliminate duplicates Z: 88 73.175 2.251 1.002 0.664 0.966 0.701 CB 1.549 88 residues pruned to eliminate duplicates Z: 89 71.769 2.253 0.945 0.652 0.966 0.750 CB 1.569 90 residues pruned to eliminate duplicates Z: 9 11.372 2.028 0.672 0.603 0.875 0.750 CB 1.229 9 residues pruned to eliminate duplicates Z: 11 15.788 2.115 0.782 0.583 0.800 0.600 CB 1.529 10 residues pruned to eliminate duplicates Z: 52 45.504 2.139 0.921 0.653 0.941 0.765 CB 1.428 52 residues pruned to eliminate duplicates Z: 19 16.447 2.015 0.480 0.465 0.889 0.611 CB 1.516 27 residues pruned to eliminate duplicates Z: 11 21.040 2.118 0.513 0.900 1.000 0.900 CB 1.483 11 residues pruned to eliminate duplicates Z: 11 23.119 2.059 0.703 0.844 1.000 0.800 CB 1.551 11 residues pruned to eliminate duplicates Z: 23 15.628 1.953 0.517 0.396 0.864 0.591 CB 1.453 23 residues pruned to eliminate duplicates Z: 18 16.745 2.172 0.486 0.410 0.882 0.588 CB 1.568 18 residues pruned to eliminate duplicates Z: 159 96.776 2.346 0.990 0.592 0.930 0.620 CB 1.623 159 residues pruned to eliminate duplicates Z: 21 17.134 1.976 0.630 0.487 0.800 0.400 CB 1.508 21 residues pruned to eliminate duplicates Z: 15 18.404 2.155 0.764 0.511 0.929 0.571 CB 1.379 15 residues pruned to eliminate duplicates Z: 15 12.330 1.814 0.493 0.522 0.929 0.500 CA 1.283 Z: 10 16.815 2.022 0.417 0.881 1.000 0.778 CB 1.417 Z: 10 19.535 1.991 0.712 0.899 1.000 1.000 CB 1.365 10 residues pruned to eliminate duplicates Z: 11 19.092 1.949 0.670 0.902 1.000 0.800 CB 1.322 11 residues pruned to eliminate duplicates Z: 10 20.532 2.095 0.561 0.890 1.000 0.556 CB 1.506 11 residues pruned to eliminate duplicates Z: 11 18.134 1.944 0.660 0.887 1.000 0.600 CB 1.281 11 residues pruned to eliminate duplicates Z: 18 14.144 2.078 0.439 0.458 0.824 0.529 CA 1.455 25 residues pruned to eliminate duplicates Z: 10 19.538 2.104 0.526 0.896 1.000 0.667 CB 1.452 10 residues pruned to eliminate duplicates Z: 17 17.932 2.073 0.549 0.435 0.938 0.562 CB 1.593 17 residues pruned to eliminate duplicates Z: 12 20.544 2.040 0.649 0.704 1.000 0.636 CA 1.530 13 residues pruned to eliminate duplicates Z: 14 19.912 1.983 0.662 0.688 0.923 0.692 CB 1.528 14 residues pruned to eliminate duplicates Z: 14 16.894 1.974 0.627 0.667 0.923 0.769 CB 1.354 14 residues pruned to eliminate duplicates Z: 9 7.849 1.606 0.208 0.769 1.000 0.750 CB 1.127 9 residues pruned to eliminate duplicates Z: 8 6.675 1.597 -0.040 0.850 1.000 1.000 CB 1.219 8 residues pruned to eliminate duplicates Z: 6 5.789 1.667 -0.015 0.854 1.000 1.000 CB 1.165 6 residues pruned to eliminate duplicates Z: 20 9.516 1.539 0.306 0.594 0.947 0.632 CB 1.048 21 residues pruned to eliminate duplicates Z: 6 3.735 1.400 0.053 0.661 1.000 0.800 CB 0.977 6 residues pruned to eliminate duplicates Z: 14 6.327 1.503 0.223 0.519 0.923 0.615 CB 1.014 14 residues pruned to eliminate duplicates Z: 20 9.752 1.559 0.248 0.594 1.000 0.789 CB 1.050 20 residues pruned to eliminate duplicates Z: 7 3.210 1.438 -0.019 0.497 1.000 0.667 CB 0.931 7 residues pruned to eliminate duplicates Z: 15 7.347 1.518 0.107 0.554 1.000 0.857 CB 1.109 15 residues pruned to eliminate duplicates Z: 20 8.242 1.490 0.323 0.557 0.895 0.579 CB 1.014 20 residues pruned to eliminate duplicates Z: 21 9.401 1.513 0.318 0.571 0.950 0.750 CB 1.036 21 residues pruned to eliminate duplicates Z: 6 3.281 1.366 0.427 0.273 1.000 0.600 CA 0.973 6 residues pruned to eliminate duplicates Z: 47 15.871 1.728 0.514 0.401 0.826 0.565 CB 1.201 47 residues pruned to eliminate duplicates Z: 11 5.853 1.547 0.384 0.438 0.800 0.600 CB 1.152 9 residues pruned to eliminate duplicates Z: 6 4.558 1.510 0.478 0.348 1.000 0.400 CB 1.077 Z: 7 9.750 1.952 0.805 0.459 0.833 0.500 CB 1.413 7 residues pruned to eliminate duplicates Z: 35 21.379 2.140 0.484 0.419 0.882 0.500 CB 1.424 35 residues pruned to eliminate duplicates Z: 68 42.264 2.274 0.742 0.495 0.896 0.612 CB 1.462 68 residues pruned to eliminate duplicates Z: 12 11.188 2.213 0.510 0.316 0.818 0.273 CA 1.513 12 residues pruned to eliminate duplicates Z: 32 27.719 2.254 0.594 0.466 0.903 0.613 CB 1.587 32 residues pruned to eliminate duplicates Z: 82 48.657 2.302 0.665 0.462 0.901 0.642 CB 1.627 82 residues pruned to eliminate duplicates Z: 31 21.341 2.187 0.473 0.432 0.833 0.500 CB 1.557 31 residues pruned to eliminate duplicates Z: 35 22.509 2.184 0.499 0.421 0.824 0.471 CB 1.555 35 residues pruned to eliminate duplicates Z: 31 25.657 2.300 0.512 0.441 0.900 0.467 CB 1.589 31 residues pruned to eliminate duplicates Z: 35 21.568 2.201 0.753 0.371 0.765 0.588 CB 1.439 35 residues pruned to eliminate duplicates Z: 31 24.433 2.267 0.575 0.429 0.900 0.667 CB 1.495 31 residues pruned to eliminate duplicates Z: 31 26.683 2.276 0.606 0.443 0.933 0.500 CB 1.514 31 residues pruned to eliminate duplicates Z: 27 17.766 2.093 0.453 0.462 0.885 0.500 CB 1.347 27 residues pruned to eliminate duplicates Z: 30 22.517 2.275 0.548 0.447 0.793 0.483 CB 1.581 30 residues pruned to eliminate duplicates Z: 34 20.973 2.176 0.430 0.404 0.848 0.636 CB 1.530 34 residues pruned to eliminate duplicates Z: 22 13.534 2.034 0.646 0.319 0.810 0.429 CB 1.332 22 residues pruned to eliminate duplicates Z: 37 30.868 2.175 0.602 0.592 0.917 0.583 CB 1.475 37 residues pruned to eliminate duplicates Z: 22 19.006 2.229 0.441 0.417 0.857 0.381 CB 1.642 22 residues pruned to eliminate duplicates Z: 17 17.194 2.181 0.471 0.393 0.938 0.500 CB 1.601 17 residues pruned to eliminate duplicates Z: 37 19.762 2.139 0.605 0.337 0.833 0.472 CB 1.375 37 residues pruned to eliminate duplicates Z: 21 28.795 2.255 0.716 0.566 0.950 0.650 CB 1.642 21 residues pruned to eliminate duplicates Z: 22 19.714 2.133 0.508 0.423 0.857 0.476 CA 1.691 22 residues pruned to eliminate duplicates Z: 14 20.976 2.285 0.693 0.464 0.923 0.846 CA 1.690 14 residues pruned to eliminate duplicates Z: 16 17.135 2.175 0.481 0.476 0.933 0.667 CB 1.509 16 residues pruned to eliminate duplicates Z: 46 33.676 2.185 0.616 0.580 0.911 0.711 CB 1.446 46 residues pruned to eliminate duplicates Z: 213 101.487 2.351 0.877 0.565 0.901 0.642 CB 1.646 213 residues pruned to eliminate duplicates Z: 214 101.575 2.346 0.858 0.551 0.930 0.653 CB 1.634 214 residues pruned to eliminate duplicates Z: 66 49.333 2.273 0.859 0.497 0.954 0.708 CB 1.522 66 residues pruned to eliminate duplicates Z: 199 101.945 2.336 0.946 0.564 0.909 0.586 CB 1.647 199 residues pruned to eliminate duplicates Z: 194 99.356 2.351 0.906 0.564 0.912 0.653 CB 1.645 194 residues pruned to eliminate duplicates Z: 91 58.468 2.339 0.789 0.520 0.900 0.578 CB 1.604 91 residues pruned to eliminate duplicates Z: 214 108.328 2.346 0.970 0.566 0.920 0.620 CB 1.638 214 residues pruned to eliminate duplicates Z: 113 79.850 2.370 1.001 0.544 0.938 0.661 CB 1.625 113 residues pruned to eliminate duplicates Z: 32 34.077 2.208 0.836 0.579 0.935 0.710 CB 1.496 32 residues pruned to eliminate duplicates Z: 45 41.834 2.234 0.860 0.577 0.955 0.659 CB 1.477 45 residues pruned to eliminate duplicates Z: 60 35.645 2.199 0.920 0.435 0.814 0.593 CB 1.446 60 residues pruned to eliminate duplicates Z: 197 105.247 2.349 0.925 0.580 0.929 0.617 CB 1.657 197 residues pruned to eliminate duplicates Z: 27 35.051 2.236 1.025 0.656 0.885 0.538 CB 1.485 27 residues pruned to eliminate duplicates Z: 65 48.784 2.290 0.890 0.527 0.922 0.672 CB 1.487 65 residues pruned to eliminate duplicates Z: 71 41.092 2.229 0.842 0.457 0.843 0.557 CB 1.483 71 residues pruned to eliminate duplicates Z: 66 44.892 2.280 0.781 0.473 0.923 0.646 CB 1.527 66 residues pruned to eliminate duplicates Z: 59 49.424 2.266 1.042 0.497 0.897 0.707 CB 1.570 59 residues pruned to eliminate duplicates Z: 27 34.281 2.213 0.948 0.665 0.923 0.577 CB 1.450 27 residues pruned to eliminate duplicates Z: 202 99.325 2.340 0.893 0.543 0.915 0.637 CB 1.657 202 residues pruned to eliminate duplicates Z: 35 28.391 2.196 0.906 0.332 0.853 0.588 CB 1.639 35 residues pruned to eliminate duplicates Z: 17 17.635 2.226 0.694 0.416 0.812 0.688 CB 1.571 17 residues pruned to eliminate duplicates Z: 58 45.755 2.291 0.958 0.463 0.912 0.702 CB 1.537 58 residues pruned to eliminate duplicates Z: 133 72.025 2.349 0.847 0.510 0.894 0.568 CB 1.600 133 residues pruned to eliminate duplicates Z: 82 50.893 2.307 0.789 0.452 0.901 0.556 CB 1.597 82 residues pruned to eliminate duplicates Z: 170 97.049 2.364 0.931 0.545 0.917 0.574 CB 1.706 170 residues pruned to eliminate duplicates Z: 60 41.622 2.265 0.813 0.508 0.881 0.661 CB 1.485 60 residues pruned to eliminate duplicates Z: 57 38.074 2.203 0.823 0.444 0.911 0.661 CB 1.473 57 residues pruned to eliminate duplicates Z: 31 27.011 2.208 1.008 0.338 0.800 0.533 CB 1.660 31 residues pruned to eliminate duplicates Z: 22 16.684 2.151 0.668 0.251 0.905 0.524 CA 1.492 22 residues pruned to eliminate duplicates Z: 60 40.566 2.227 0.755 0.503 0.898 0.593 CB 1.500 60 residues pruned to eliminate duplicates Z: 146 84.520 2.384 0.973 0.540 0.890 0.593 CB 1.614 146 residues pruned to eliminate duplicates Z: 27 16.902 2.113 0.638 0.259 0.808 0.500 CB 1.562 27 residues pruned to eliminate duplicates Z: 72 45.704 2.257 0.868 0.458 0.873 0.648 CB 1.538 72 residues pruned to eliminate duplicates Z: 99 68.560 2.382 0.915 0.504 0.888 0.561 CB 1.702 99 residues pruned to eliminate duplicates Z: 89 66.654 2.385 0.949 0.501 0.909 0.602 CB 1.680 89 residues pruned to eliminate duplicates Z: 68 48.430 2.263 0.864 0.491 0.910 0.612 CB 1.555 68 residues pruned to eliminate duplicates Z: 115 78.098 2.384 0.978 0.504 0.904 0.596 CB 1.710 115 residues pruned to eliminate duplicates Z: 46 42.656 2.234 0.921 0.499 0.911 0.622 CB 1.629 46 residues pruned to eliminate duplicates Z: 82 41.838 2.236 0.697 0.425 0.877 0.556 CB 1.511 82 residues pruned to eliminate duplicates Z: 75 49.344 2.268 0.824 0.484 0.905 0.662 CB 1.556 75 residues pruned to eliminate duplicates Z: 148 80.254 2.358 0.884 0.530 0.884 0.585 CB 1.636 148 residues pruned to eliminate duplicates Z: 87 45.383 2.180 0.799 0.450 0.884 0.581 CB 1.487 87 residues pruned to eliminate duplicates Z: 91 66.959 2.339 0.947 0.520 0.911 0.633 CB 1.666 91 residues pruned to eliminate duplicates Z: 65 50.650 2.325 0.894 0.514 0.859 0.562 CB 1.650 65 residues pruned to eliminate duplicates Z: 21 15.303 2.200 0.758 0.260 0.750 0.450 CA 1.551 21 residues pruned to eliminate duplicates Z: 28 36.317 2.355 0.760 0.618 0.926 0.704 CB 1.628 28 residues pruned to eliminate duplicates Z: 128 92.916 2.393 0.906 0.624 0.921 0.677 CB 1.746 128 residues pruned to eliminate duplicates Z: 167 92.590 2.342 0.898 0.564 0.928 0.627 CB 1.638 167 residues pruned to eliminate duplicates Z: 65 58.444 2.408 0.898 0.560 0.906 0.625 CB 1.665 65 residues pruned to eliminate duplicates Z: 79 54.476 2.322 0.829 0.513 0.910 0.641 CB 1.574 79 residues pruned to eliminate duplicates Z: 61 61.824 2.402 1.032 0.573 0.900 0.600 CB 1.693 61 residues pruned to eliminate duplicates Z: 67 60.340 2.379 0.981 0.543 0.909 0.576 CB 1.662 67 residues pruned to eliminate duplicates Z: 74 73.439 2.446 1.036 0.598 0.918 0.658 CB 1.712 74 residues pruned to eliminate duplicates Z: 137 95.132 2.401 0.938 0.613 0.926 0.647 CB 1.700 137 residues pruned to eliminate duplicates Z: 61 65.638 2.430 0.957 0.594 0.933 0.683 CB 1.745 61 residues pruned to eliminate duplicates Z: 87 83.251 2.456 1.038 0.606 0.930 0.640 CB 1.744 87 residues pruned to eliminate duplicates Z: 59 60.050 2.415 0.937 0.580 0.931 0.655 CB 1.676 59 residues pruned to eliminate duplicates Z: 169 100.059 2.361 0.952 0.575 0.935 0.637 CB 1.668 169 residues pruned to eliminate duplicates Z: 159 98.329 2.361 0.977 0.584 0.930 0.633 CB 1.661 159 residues pruned to eliminate duplicates Z: 125 83.714 2.373 1.066 0.553 0.871 0.621 CB 1.672 125 residues pruned to eliminate duplicates Z: 71 68.679 2.482 0.852 0.622 0.914 0.657 CB 1.741 71 residues pruned to eliminate duplicates Z: 134 92.378 2.397 0.931 0.602 0.910 0.579 CB 1.726 134 residues pruned to eliminate duplicates Z: 88 78.667 2.461 0.946 0.599 0.943 0.609 CB 1.700 88 residues pruned to eliminate duplicates Z: 61 57.261 2.422 0.928 0.565 0.883 0.467 CB 1.683 61 residues pruned to eliminate duplicates Z: 29 45.836 2.406 1.168 0.587 0.929 0.607 CB 1.645 29 residues pruned to eliminate duplicates Z: 26 38.932 2.309 1.192 0.580 0.880 0.600 CB 1.619 26 residues pruned to eliminate duplicates Z: 131 93.385 2.367 0.987 0.614 0.931 0.615 CB 1.680 131 residues pruned to eliminate duplicates Z: 37 48.615 2.388 1.202 0.566 0.917 0.667 CB 1.577 37 residues pruned to eliminate duplicates Z: 28 34.598 2.168 1.244 0.526 0.852 0.556 CB 1.566 28 residues pruned to eliminate duplicates Z: 29 31.471 2.234 1.152 0.515 0.893 0.464 CB 1.365 29 residues pruned to eliminate duplicates Z: 59 65.868 2.452 1.069 0.590 0.931 0.638 CB 1.680 59 residues pruned to eliminate duplicates Z: 64 59.284 2.355 1.001 0.557 0.921 0.603 CB 1.628 64 residues pruned to eliminate duplicates Z: 61 65.916 2.438 1.000 0.581 0.967 0.600 CB 1.670 61 residues pruned to eliminate duplicates Z: 62 64.537 2.415 1.021 0.590 0.902 0.623 CB 1.723 62 residues pruned to eliminate duplicates Z: 62 61.205 2.445 0.936 0.578 0.918 0.607 CB 1.673 62 residues pruned to eliminate duplicates Z: 27 33.630 2.269 1.175 0.536 0.846 0.346 CB 1.525 27 residues pruned to eliminate duplicates Z: 56 64.147 2.464 1.039 0.594 0.927 0.636 CB 1.697 56 residues pruned to eliminate duplicates Z: 80 72.258 2.448 1.043 0.568 0.911 0.620 CB 1.671 80 residues pruned to eliminate duplicates Z: 36 52.143 2.444 1.134 0.592 0.943 0.600 CB 1.640 36 residues pruned to eliminate duplicates Z: 26 39.159 2.332 1.330 0.565 0.920 0.560 CB 1.471 26 residues pruned to eliminate duplicates Z: 90 81.288 2.438 1.067 0.576 0.921 0.596 CB 1.724 90 residues pruned to eliminate duplicates Z: 64 60.150 2.410 0.995 0.565 0.905 0.556 CB 1.636 64 residues pruned to eliminate duplicates Z: 60 62.920 2.408 1.013 0.576 0.932 0.559 CB 1.685 60 residues pruned to eliminate duplicates Z: 83 69.801 2.332 0.946 0.611 0.902 0.622 CB 1.695 83 residues pruned to eliminate duplicates Z: 87 76.010 2.423 1.000 0.590 0.930 0.651 CB 1.669 87 residues pruned to eliminate duplicates Z: 85 74.802 2.312 0.965 0.634 0.940 0.643 CB 1.684 85 residues pruned to eliminate duplicates Z: 86 75.442 2.334 1.029 0.625 0.918 0.671 CB 1.673 86 residues pruned to eliminate duplicates Z: 84 72.261 2.332 0.877 0.655 0.940 0.639 CB 1.669 84 residues pruned to eliminate duplicates Z: 95 70.876 2.293 0.826 0.607 0.936 0.649 CB 1.685 95 residues pruned to eliminate duplicates Z: 75 68.752 2.358 0.954 0.641 0.892 0.676 CB 1.705 75 residues pruned to eliminate duplicates Z: 76 71.918 2.335 0.993 0.638 0.920 0.680 CB 1.704 76 residues pruned to eliminate duplicates Z: 29 46.501 2.441 1.021 0.622 0.929 0.571 CB 1.709 29 residues pruned to eliminate duplicates Z: 33 45.816 2.332 1.020 0.629 0.906 0.594 CB 1.681 33 residues pruned to eliminate duplicates Z: 32 51.381 2.445 1.100 0.620 0.903 0.613 CB 1.776 32 residues pruned to eliminate duplicates Z: 32 52.168 2.450 1.151 0.619 0.903 0.516 CA 1.759 32 residues pruned to eliminate duplicates Z: 39 50.548 2.386 1.006 0.653 0.868 0.500 CB 1.711 39 residues pruned to eliminate duplicates Z: 112 84.600 2.328 1.038 0.639 0.919 0.649 CB 1.617 112 residues pruned to eliminate duplicates Z: 31 55.308 2.466 1.230 0.649 0.900 0.567 CB 1.776 31 residues pruned to eliminate duplicates Z: 32 51.865 2.426 1.076 0.616 0.935 0.710 CB 1.771 32 residues pruned to eliminate duplicates Z: 21 40.798 2.503 1.057 0.641 0.900 0.750 CB 1.726 21 residues pruned to eliminate duplicates Z: 31 41.904 2.286 1.016 0.569 0.900 0.467 CB 1.726 31 residues pruned to eliminate duplicates Z: 33 48.813 2.437 1.020 0.624 0.875 0.656 CB 1.782 33 residues pruned to eliminate duplicates Z: 74 62.745 2.292 0.845 0.609 0.945 0.644 CB 1.657 74 residues pruned to eliminate duplicates Z: 32 48.480 2.404 1.053 0.589 0.903 0.613 CB 1.794 32 residues pruned to eliminate duplicates Z: 28 58.533 2.481 1.275 0.644 0.963 0.667 CB 1.812 28 residues pruned to eliminate duplicates Z: 17 23.108 2.216 1.181 0.438 0.875 0.438 CB 1.455 17 residues pruned to eliminate duplicates Z: 17 31.491 2.316 1.116 0.500 0.938 0.438 CA 1.714 17 residues pruned to eliminate duplicates Z: 82 76.981 2.349 0.972 0.673 0.951 0.667 CB 1.656 82 residues pruned to eliminate duplicates Z: 113 81.231 2.348 0.927 0.619 0.911 0.598 CB 1.664 113 residues pruned to eliminate duplicates Z: 35 54.205 2.365 1.161 0.640 0.912 0.500 CB 1.750 35 residues pruned to eliminate duplicates Z: 84 77.282 2.347 1.006 0.653 0.940 0.627 CB 1.663 84 residues pruned to eliminate duplicates Z: 80 72.878 2.305 1.001 0.633 0.924 0.557 CB 1.699 80 residues pruned to eliminate duplicates Z: 87 74.929 2.356 0.923 0.633 0.919 0.605 CB 1.714 87 residues pruned to eliminate duplicates Z: 76 68.793 2.328 0.964 0.640 0.907 0.627 CB 1.680 76 residues pruned to eliminate duplicates Z: 84 79.772 2.347 1.045 0.648 0.940 0.602 CB 1.690 84 residues pruned to eliminate duplicates Z: 89 68.504 2.289 0.922 0.609 0.932 0.648 CB 1.606 89 residues pruned to eliminate duplicates Z: 71 61.490 2.271 0.859 0.595 0.971 0.686 CB 1.637 71 residues pruned to eliminate duplicates Z: 84 73.608 2.340 1.030 0.667 0.916 0.651 CB 1.592 84 residues pruned to eliminate duplicates Z: 146 107.447 2.412 1.041 0.618 0.945 0.621 CB 1.716 146 residues pruned to eliminate duplicates Z: 91 73.529 2.302 0.968 0.623 0.933 0.644 CB 1.633 91 residues pruned to eliminate duplicates Z: 118 89.056 2.329 1.086 0.609 0.932 0.598 CB 1.640 118 residues pruned to eliminate duplicates Z: 83 73.698 2.316 1.029 0.662 0.927 0.646 CB 1.608 83 residues pruned to eliminate duplicates Z: 76 77.897 2.356 1.040 0.651 0.947 0.680 CB 1.718 76 residues pruned to eliminate duplicates Z: 57 58.589 2.273 0.953 0.655 0.929 0.714 CB 1.644 57 residues pruned to eliminate duplicates Z: 70 69.012 2.285 1.069 0.627 0.957 0.696 CB 1.630 70 residues pruned to eliminate duplicates Z: 82 81.411 2.369 1.023 0.651 0.963 0.704 CB 1.703 82 residues pruned to eliminate duplicates Z: 85 81.174 2.344 1.123 0.619 0.952 0.643 CB 1.670 85 residues pruned to eliminate duplicates Z: 68 70.692 2.293 1.024 0.627 0.985 0.716 CB 1.676 68 residues pruned to eliminate duplicates Z: 127 88.686 2.319 1.022 0.599 0.952 0.683 CB 1.609 75 residues pruned to eliminate duplicates Z: 16 28.414 2.175 0.765 0.917 1.000 0.867 CA 1.349 16 residues pruned to eliminate duplicates Z: 68 70.646 2.301 1.062 0.646 0.970 0.716 CB 1.637 68 residues pruned to eliminate duplicates Z: 83 76.479 2.340 1.020 0.649 0.951 0.695 CB 1.635 83 residues pruned to eliminate duplicates Z: 49 55.294 2.241 0.893 0.644 1.000 0.625 CB 1.644 49 residues pruned to eliminate duplicates Z: 58 58.976 2.204 1.050 0.616 0.982 0.649 CB 1.576 58 residues pruned to eliminate duplicates Z: 82 72.842 2.315 1.056 0.629 0.951 0.642 CB 1.584 82 residues pruned to eliminate duplicates Z: 61 63.207 2.295 1.017 0.607 0.950 0.617 CB 1.676 61 residues pruned to eliminate duplicates Z: 82 76.428 2.348 1.124 0.631 0.914 0.630 CB 1.647 82 residues pruned to eliminate duplicates Z: 84 72.321 2.305 1.070 0.618 0.940 0.651 CB 1.583 84 residues pruned to eliminate duplicates Z: 64 52.482 2.190 0.908 0.596 0.905 0.603 CB 1.596 64 residues pruned to eliminate duplicates Z: 36 33.877 2.152 0.921 0.506 0.857 0.629 CB 1.607 36 residues pruned to eliminate duplicates Z: 31 45.250 2.324 0.811 0.703 0.967 0.733 CB 1.688 31 residues pruned to eliminate duplicates Z: 85 77.914 2.330 1.068 0.650 0.940 0.607 CB 1.631 85 residues pruned to eliminate duplicates Z: 84 77.884 2.344 1.108 0.637 0.916 0.675 CB 1.662 84 residues pruned to eliminate duplicates Z: 51 43.975 2.153 0.857 0.627 0.900 0.640 CB 1.534 51 residues pruned to eliminate duplicates Z: 87 79.297 2.378 0.938 0.645 0.953 0.651 CB 1.700 87 residues pruned to eliminate duplicates Z: 84 74.260 2.339 0.948 0.633 0.952 0.687 CB 1.659 84 residues pruned to eliminate duplicates Z: 84 70.901 2.328 0.924 0.622 0.940 0.663 CB 1.648 84 residues pruned to eliminate duplicates Z: 75 75.530 2.358 0.972 0.645 0.959 0.716 CB 1.719 75 residues pruned to eliminate duplicates Z: 84 76.602 2.344 0.918 0.658 0.976 0.675 CB 1.656 84 residues pruned to eliminate duplicates Z: 85 70.267 2.286 0.960 0.646 0.929 0.738 CB 1.608 85 residues pruned to eliminate duplicates Z: 85 78.259 2.331 1.039 0.642 0.952 0.631 CB 1.652 85 residues pruned to eliminate duplicates Z: 33 34.970 2.261 0.919 0.553 0.938 0.562 CB 1.443 33 residues pruned to eliminate duplicates Z: 87 85.375 2.360 1.070 0.661 0.953 0.709 CB 1.702 87 residues pruned to eliminate duplicates Z: 16 21.114 2.235 1.145 0.410 0.933 0.667 CB 1.339 16 residues pruned to eliminate duplicates Z: 84 81.666 2.346 1.074 0.658 0.952 0.602 CB 1.673 84 residues pruned to eliminate duplicates Z: 81 84.818 2.361 1.073 0.674 0.963 0.675 CB 1.714 81 residues pruned to eliminate duplicates Z: 57 58.452 2.252 0.966 0.644 0.964 0.679 CB 1.599 57 residues pruned to eliminate duplicates Z: 69 56.705 2.222 0.932 0.604 0.926 0.574 CB 1.566 69 residues pruned to eliminate duplicates Z: 89 71.934 2.297 0.994 0.616 0.920 0.614 CB 1.629 89 residues pruned to eliminate duplicates Z: 88 73.470 2.333 0.975 0.631 0.920 0.655 CB 1.644 88 residues pruned to eliminate duplicates Z: 88 76.266 2.342 1.011 0.604 0.931 0.632 CB 1.688 20 residues pruned to eliminate duplicates Z: 6 10.858 1.948 0.620 0.418 1.000 1.000 N 1.676 6 residues pruned to eliminate duplicates Z: 12 16.295 2.031 0.792 0.482 0.818 0.364 CA 1.681 12 residues pruned to eliminate duplicates Z: 117 91.787 2.385 0.980 0.618 0.931 0.698 CB 1.734 117 residues pruned to eliminate duplicates Z: 7 24.741 2.310 1.113 0.854 1.000 1.000 CA 1.528 8 residues pruned to eliminate duplicates Z: 6 9.919 1.822 0.964 0.382 1.000 0.600 N 1.405 5 residues pruned to eliminate duplicates Z: 8 7.216 1.759 0.663 0.521 0.714 0.571 N 1.279 Z: 7 3.331 1.945 0.238 0.387 0.500 0.167 CB 1.273 Z: 6 5.382 1.766 0.958 0.403 1.000 0.600 CA 0.771 Z: 6 9.749 1.903 0.877 0.420 1.000 0.600 CA 1.327 Z: 7 6.797 1.971 0.373 0.429 0.833 0.667 CA 1.325 Z: 14 18.974 1.955 0.864 0.651 0.923 0.462 CB 1.359 14 residues pruned to eliminate duplicates Z: 14 16.829 2.100 0.519 0.553 0.923 0.615 CB 1.505 11 residues pruned to eliminate duplicates Z: 9 24.032 2.312 0.660 0.891 1.000 0.875 CB 1.592 9 residues pruned to eliminate duplicates Z: 16 18.082 2.089 0.800 0.475 0.867 0.467 CB 1.469 16 residues pruned to eliminate duplicates Z: 21 16.304 2.105 0.545 0.390 0.900 0.450 CB 1.400 23 residues pruned to eliminate duplicates Z: 9 25.748 2.269 0.889 0.879 1.000 0.875 CB 1.541 9 residues pruned to eliminate duplicates Z: 16 23.165 2.108 0.892 0.519 0.867 0.467 CB 1.699 16 residues pruned to eliminate duplicates Z: 11 17.417 2.121 0.724 0.806 0.900 0.800 CB 1.281 11 residues pruned to eliminate duplicates Z: 22 16.404 2.018 0.601 0.358 0.952 0.476 CB 1.356 22 residues pruned to eliminate duplicates Z: 20 18.634 2.070 0.609 0.379 0.947 0.474 CB 1.541 20 residues pruned to eliminate duplicates Z: 20 17.193 2.051 0.603 0.422 0.842 0.579 CA 1.544 20 residues pruned to eliminate duplicates Z: 16 20.549 2.078 0.901 0.470 0.933 0.467 CB 1.483 16 residues pruned to eliminate duplicates Z: 48 28.104 2.117 0.755 0.420 0.830 0.468 CB 1.445 48 residues pruned to eliminate duplicates Z: 40 24.784 2.087 0.578 0.474 0.897 0.462 CB 1.379 40 residues pruned to eliminate duplicates Z: 45 33.789 2.156 0.508 0.584 0.932 0.614 CB 1.552 45 residues pruned to eliminate duplicates Z: 41 23.526 2.118 0.546 0.430 0.900 0.575 CB 1.357 41 residues pruned to eliminate duplicates Z: 21 20.778 2.183 0.547 0.532 0.950 0.700 CB 1.403 21 residues pruned to eliminate duplicates Z: 92 40.866 2.132 0.686 0.436 0.835 0.582 CB 1.524 90 residues pruned to eliminate duplicates Z: 7 6.819 1.764 0.609 0.514 0.833 0.667 CA 1.161 7 residues pruned to eliminate duplicates Z: 19 18.011 2.232 0.709 0.458 0.889 0.611 CB 1.307 19 residues pruned to eliminate duplicates Z: 21 19.204 2.167 0.661 0.501 0.850 0.700 CB 1.403 21 residues pruned to eliminate duplicates Z: 54 41.250 2.186 0.768 0.533 0.925 0.679 CB 1.535 54 residues pruned to eliminate duplicates Z: 23 21.479 2.212 0.695 0.481 0.818 0.636 CB 1.521 23 residues pruned to eliminate duplicates Z: 46 37.879 2.163 0.699 0.576 0.911 0.733 CB 1.567 46 residues pruned to eliminate duplicates Z: 23 11.394 1.902 0.494 0.330 0.727 0.591 CB 1.417 23 residues pruned to eliminate duplicates Z: 62 41.252 2.144 0.742 0.550 0.902 0.656 CB 1.493 62 residues pruned to eliminate duplicates Z: 12 18.987 2.055 0.607 0.841 0.909 0.909 CB 1.422 12 residues pruned to eliminate duplicates Z: 12 15.879 2.238 0.643 0.614 0.818 0.727 CB 1.428 12 residues pruned to eliminate duplicates Z: 27 18.773 2.048 0.603 0.429 0.846 0.577 CB 1.426 27 residues pruned to eliminate duplicates Z: 61 39.906 2.181 0.616 0.551 0.900 0.583 CB 1.546 61 residues pruned to eliminate duplicates Z: 143 71.815 2.228 0.801 0.528 0.937 0.620 CB 1.560 146 residues pruned to eliminate duplicates Z: 12 24.449 2.134 0.660 0.783 1.000 0.727 CA 1.622 12 residues pruned to eliminate duplicates Z: 56 38.553 2.144 0.636 0.580 0.909 0.618 CB 1.510 56 residues pruned to eliminate duplicates Z: 157 77.737 2.242 0.842 0.543 0.917 0.596 CB 1.576 157 residues pruned to eliminate duplicates Z: 31 27.721 2.203 0.647 0.467 0.933 0.600 CB 1.545 31 residues pruned to eliminate duplicates Z: 22 25.037 2.216 0.639 0.500 1.000 0.619 CB 1.504 22 residues pruned to eliminate duplicates Z: 60 31.428 2.097 0.671 0.443 0.864 0.492 CB 1.433 56 residues pruned to eliminate duplicates Z: 7 8.197 1.672 0.715 0.450 1.000 0.833 CB 1.229 7 residues pruned to eliminate duplicates Z: 23 23.088 2.174 0.710 0.508 0.909 0.591 CB 1.445 23 residues pruned to eliminate duplicates Z: 24 20.167 2.095 0.625 0.482 0.870 0.435 CB 1.446 24 residues pruned to eliminate duplicates Z: 36 35.882 2.191 0.638 0.662 0.943 0.686 CB 1.543 36 residues pruned to eliminate duplicates Z: 93 50.963 2.192 0.799 0.490 0.880 0.598 CB 1.546 93 residues pruned to eliminate duplicates Z: 94 53.232 2.193 0.709 0.519 0.935 0.613 CB 1.545 94 residues pruned to eliminate duplicates Z: 67 43.532 2.157 0.794 0.492 0.924 0.576 CB 1.511 67 residues pruned to eliminate duplicates Z: 68 43.207 2.147 0.829 0.481 0.910 0.642 CB 1.504 68 residues pruned to eliminate duplicates Z: 45 40.630 2.211 0.750 0.609 0.932 0.773 CB 1.532 45 residues pruned to eliminate duplicates Z: 82 42.765 2.121 0.688 0.482 0.889 0.580 CB 1.520 84 residues pruned to eliminate duplicates Z: 16 28.886 2.055 0.827 0.885 0.933 0.600 CB 1.536 16 residues pruned to eliminate duplicates Z: 102 63.449 2.247 0.840 0.539 0.931 0.614 CB 1.579 102 residues pruned to eliminate duplicates Z: 68 40.763 2.140 0.746 0.483 0.896 0.597 CB 1.514 68 residues pruned to eliminate duplicates Z: 93 50.618 2.161 0.739 0.488 0.957 0.641 CB 1.486 93 residues pruned to eliminate duplicates Z: 129 85.296 2.379 0.931 0.550 0.914 0.625 CB 1.710 129 residues pruned to eliminate duplicates Z: 85 44.462 2.113 0.702 0.465 0.952 0.560 CB 1.468 85 residues pruned to eliminate duplicates Z: 16 33.951 2.112 1.006 0.925 0.933 0.733 CB 1.556 16 residues pruned to eliminate duplicates Z: 74 41.948 2.128 0.732 0.480 0.904 0.658 CB 1.504 74 residues pruned to eliminate duplicates Z: 45 42.811 2.199 0.827 0.562 0.977 0.659 CB 1.548 45 residues pruned to eliminate duplicates Z: 45 41.240 2.196 0.811 0.576 0.932 0.682 CB 1.560 45 residues pruned to eliminate duplicates Z: 69 36.369 2.084 0.726 0.492 0.868 0.456 CB 1.425 76 residues pruned to eliminate duplicates Z: 16 34.520 2.103 0.900 0.926 1.000 0.867 CB 1.564 16 residues pruned to eliminate duplicates Z: 95 56.984 2.182 0.796 0.522 0.947 0.681 CB 1.549 95 residues pruned to eliminate duplicates Z: 67 44.111 2.154 0.794 0.489 0.909 0.576 CB 1.563 67 residues pruned to eliminate duplicates Z: 210 102.116 2.274 0.967 0.578 0.923 0.617 CB 1.586 210 residues pruned to eliminate duplicates Z: 29 21.029 2.100 0.803 0.305 0.821 0.500 CB 1.587 29 residues pruned to eliminate duplicates Z: 67 42.371 2.130 0.775 0.491 0.924 0.545 CB 1.507 67 residues pruned to eliminate duplicates Z: 131 59.262 2.181 0.800 0.505 0.862 0.569 CB 1.529 131 residues pruned to eliminate duplicates Z: 55 37.608 2.144 0.709 0.542 0.907 0.667 CB 1.477 55 residues pruned to eliminate duplicates Z: 25 13.414 1.857 0.622 0.334 0.750 0.500 CA 1.452 25 residues pruned to eliminate duplicates Z: 211 96.884 2.276 0.890 0.571 0.910 0.605 CB 1.595 211 residues pruned to eliminate duplicates Z: 214 95.550 2.257 0.846 0.567 0.948 0.587 CB 1.553 214 residues pruned to eliminate duplicates Z: 105 76.889 2.280 0.996 0.557 0.962 0.529 CB 1.630 105 residues pruned to eliminate duplicates Z: 68 42.072 2.126 0.805 0.489 0.896 0.627 CB 1.513 68 residues pruned to eliminate duplicates Z: 70 38.796 2.135 0.687 0.467 0.899 0.638 CB 1.492 70 residues pruned to eliminate duplicates Z: 89 46.529 2.140 0.760 0.469 0.909 0.648 CB 1.495 89 residues pruned to eliminate duplicates Z: 219 98.364 2.260 0.905 0.557 0.927 0.596 CB 1.581 229 residues pruned to eliminate duplicates Z: 6 3.906 1.491 0.600 0.375 1.000 0.600 CA 0.837 6 residues pruned to eliminate duplicates Z: 195 92.929 2.249 0.882 0.568 0.933 0.598 CB 1.582 195 residues pruned to eliminate duplicates Z: 87 51.538 2.144 0.787 0.503 0.919 0.570 CB 1.575 87 residues pruned to eliminate duplicates Z: 51 38.142 2.170 0.717 0.452 0.960 0.600 CB 1.584 51 residues pruned to eliminate duplicates Z: 144 94.753 2.313 1.047 0.589 0.951 0.601 CB 1.616 144 residues pruned to eliminate duplicates Z: 74 45.680 2.150 0.777 0.488 0.945 0.685 CB 1.498 74 residues pruned to eliminate duplicates Z: 72 35.870 2.104 0.682 0.422 0.873 0.620 CB 1.494 72 residues pruned to eliminate duplicates Z: 17 19.979 2.117 1.018 0.341 0.875 0.562 CB 1.590 17 residues pruned to eliminate duplicates Z: 88 50.707 2.187 0.743 0.516 0.920 0.644 CB 1.527 88 residues pruned to eliminate duplicates Z: 91 66.476 2.310 0.849 0.564 0.944 0.611 CB 1.633 91 residues pruned to eliminate duplicates Z: 128 67.876 2.232 0.775 0.546 0.945 0.654 CB 1.539 128 residues pruned to eliminate duplicates Z: 159 89.548 2.279 0.950 0.576 0.930 0.620 CB 1.602 159 residues pruned to eliminate duplicates Z: 152 93.909 2.322 0.970 0.602 0.940 0.662 CB 1.612 152 residues pruned to eliminate duplicates Z: 140 93.994 2.320 1.010 0.620 0.950 0.640 CB 1.608 140 residues pruned to eliminate duplicates Z: 170 80.271 2.240 0.890 0.551 0.893 0.586 CB 1.552 170 residues pruned to eliminate duplicates Z: 143 84.554 2.269 0.864 0.602 0.930 0.634 CB 1.637 143 residues pruned to eliminate duplicates Z: 101 75.159 2.319 0.977 0.553 0.940 0.580 CB 1.656 101 residues pruned to eliminate duplicates Z: 37 37.883 2.200 0.834 0.472 1.000 0.722 CB 1.610 37 residues pruned to eliminate duplicates Z: 80 47.870 2.151 0.784 0.499 0.886 0.646 CB 1.585 80 residues pruned to eliminate duplicates Z: 148 75.395 2.264 0.818 0.533 0.925 0.619 CB 1.581 148 residues pruned to eliminate duplicates Z: 37 33.038 2.168 0.759 0.474 0.917 0.611 CB 1.618 37 residues pruned to eliminate duplicates Z: 22 35.821 2.314 0.988 0.606 0.905 0.571 CB 1.698 22 residues pruned to eliminate duplicates Z: 116 86.319 2.303 1.029 0.644 0.913 0.591 CB 1.649 116 residues pruned to eliminate duplicates Z: 147 84.764 2.296 0.920 0.606 0.932 0.575 CB 1.544 147 residues pruned to eliminate duplicates Z: 74 68.772 2.373 0.980 0.607 0.932 0.575 CB 1.662 74 residues pruned to eliminate duplicates Z: 26 32.029 2.265 0.868 0.588 0.880 0.640 CB 1.581 26 residues pruned to eliminate duplicates Z: 24 34.953 2.272 0.887 0.569 0.957 0.478 CA 1.662 24 residues pruned to eliminate duplicates Z: 25 35.302 2.256 0.929 0.590 0.917 0.625 CA 1.657 25 residues pruned to eliminate duplicates Z: 142 79.942 2.252 0.887 0.570 0.915 0.603 CB 1.618 142 residues pruned to eliminate duplicates Z: 141 81.787 2.294 0.910 0.590 0.914 0.614 CB 1.583 141 residues pruned to eliminate duplicates Z: 205 100.191 2.274 0.921 0.595 0.936 0.637 CB 1.566 205 residues pruned to eliminate duplicates Z: 146 95.684 2.312 1.075 0.615 0.931 0.641 CB 1.595 146 residues pruned to eliminate duplicates Z: 119 85.159 2.318 1.013 0.622 0.924 0.636 CB 1.621 119 residues pruned to eliminate duplicates Z: 39 41.735 2.305 0.873 0.556 0.947 0.658 CB 1.568 39 residues pruned to eliminate duplicates Z: 114 92.349 2.350 1.038 0.647 0.965 0.681 CB 1.640 114 residues pruned to eliminate duplicates Z: 38 38.020 2.227 0.956 0.562 0.892 0.649 CB 1.515 38 residues pruned to eliminate duplicates Z: 119 83.793 2.320 0.990 0.625 0.924 0.627 CB 1.607 119 residues pruned to eliminate duplicates Z: 26 38.033 2.288 1.155 0.565 0.920 0.720 CB 1.574 26 residues pruned to eliminate duplicates Z: 114 79.627 2.302 0.955 0.616 0.912 0.593 CB 1.636 114 residues pruned to eliminate duplicates Z: 33 44.959 2.333 0.993 0.630 0.969 0.656 CB 1.562 33 residues pruned to eliminate duplicates Z: 33 51.072 2.350 1.172 0.621 0.969 0.656 CB 1.629 33 residues pruned to eliminate duplicates Z: 106 88.666 2.335 1.079 0.646 0.962 0.648 CB 1.617 106 residues pruned to eliminate duplicates Z: 38 42.899 2.301 1.071 0.548 0.892 0.568 CB 1.583 38 residues pruned to eliminate duplicates Z: 35 47.581 2.356 1.092 0.580 0.941 0.647 CB 1.628 35 residues pruned to eliminate duplicates Z: 102 88.255 2.344 1.078 0.658 0.941 0.653 CB 1.655 102 residues pruned to eliminate duplicates Z: 35 49.616 2.381 1.090 0.592 0.941 0.588 CB 1.663 35 residues pruned to eliminate duplicates Z: 37 47.812 2.380 1.017 0.560 0.944 0.639 CB 1.657 37 residues pruned to eliminate duplicates Z: 29 36.560 2.228 1.056 0.517 0.964 0.500 CB 1.538 29 residues pruned to eliminate duplicates Z: 102 84.781 2.333 1.047 0.660 0.941 0.644 CB 1.619 102 residues pruned to eliminate duplicates Z: 102 88.632 2.339 1.114 0.661 0.941 0.614 CB 1.634 102 residues pruned to eliminate duplicates Z: 119 89.910 2.332 1.065 0.644 0.924 0.610 CB 1.626 119 residues pruned to eliminate duplicates Z: 110 86.293 2.337 1.031 0.628 0.945 0.615 CB 1.634 110 residues pruned to eliminate duplicates Z: 27 36.308 2.256 1.079 0.535 0.923 0.538 CB 1.589 27 residues pruned to eliminate duplicates Z: 36 47.677 2.295 1.064 0.595 0.971 0.571 CB 1.599 36 residues pruned to eliminate duplicates Z: 108 87.388 2.345 1.075 0.647 0.944 0.626 CB 1.604 108 residues pruned to eliminate duplicates Z: 89 78.449 2.357 1.068 0.608 0.932 0.648 CB 1.662 89 residues pruned to eliminate duplicates Z: 87 78.646 2.360 1.144 0.574 0.953 0.558 CB 1.637 87 residues pruned to eliminate duplicates Z: 108 85.606 2.315 1.050 0.633 0.953 0.636 CB 1.615 108 residues pruned to eliminate duplicates Z: 119 85.922 2.317 1.038 0.638 0.932 0.661 CB 1.579 119 residues pruned to eliminate duplicates Z: 27 40.437 2.355 1.029 0.536 1.000 0.577 CB 1.601 27 residues pruned to eliminate duplicates Z: 115 90.707 2.348 1.029 0.645 0.939 0.588 CB 1.660 115 residues pruned to eliminate duplicates Z: 114 85.383 2.342 1.000 0.640 0.920 0.602 CB 1.635 114 residues pruned to eliminate duplicates Z: 72 65.152 2.293 0.975 0.654 0.873 0.563 CB 1.694 72 residues pruned to eliminate duplicates Z: 22 38.956 2.379 1.106 0.607 0.857 0.619 CA 1.788 22 residues pruned to eliminate duplicates Z: 126 84.419 2.291 1.014 0.613 0.920 0.584 CB 1.598 126 residues pruned to eliminate duplicates Z: 71 68.740 2.304 0.988 0.665 0.929 0.657 CB 1.657 71 residues pruned to eliminate duplicates Z: 86 63.270 2.214 0.829 0.607 0.929 0.624 CB 1.648 86 residues pruned to eliminate duplicates Z: 57 69.745 2.383 1.234 0.607 0.946 0.607 CB 1.671 57 residues pruned to eliminate duplicates Z: 89 73.070 2.302 1.030 0.634 0.932 0.636 CB 1.578 89 residues pruned to eliminate duplicates Z: 107 86.422 2.326 1.091 0.640 0.934 0.566 CB 1.622 107 residues pruned to eliminate duplicates Z: 141 94.231 2.308 0.974 0.633 0.957 0.579 CB 1.612 141 residues pruned to eliminate duplicates Z: 74 73.350 2.317 1.266 0.636 0.918 0.548 CB 1.568 74 residues pruned to eliminate duplicates Z: 85 69.722 2.292 0.992 0.631 0.893 0.500 CB 1.649 85 residues pruned to eliminate duplicates Z: 66 71.827 2.384 1.190 0.613 0.908 0.600 CB 1.690 66 residues pruned to eliminate duplicates Z: 70 70.009 2.302 1.016 0.689 0.913 0.536 CB 1.674 70 residues pruned to eliminate duplicates Z: 83 69.373 2.293 0.931 0.643 0.951 0.585 CB 1.590 83 residues pruned to eliminate duplicates Z: 84 75.859 2.323 1.088 0.636 0.916 0.627 CB 1.650 84 residues pruned to eliminate duplicates Z: 90 67.273 2.278 0.964 0.606 0.899 0.596 CB 1.603 90 residues pruned to eliminate duplicates Z: 76 72.797 2.330 1.088 0.643 0.933 0.653 CB 1.619 76 residues pruned to eliminate duplicates Z: 120 87.836 2.321 1.063 0.638 0.950 0.597 CB 1.556 120 residues pruned to eliminate duplicates Z: 48 49.043 2.224 1.055 0.566 0.894 0.489 CB 1.643 48 residues pruned to eliminate duplicates Z: 85 77.815 2.305 1.062 0.650 0.952 0.619 CB 1.631 85 residues pruned to eliminate duplicates Z: 70 75.499 2.311 1.078 0.669 0.942 0.652 CB 1.718 70 residues pruned to eliminate duplicates Z: 89 72.878 2.295 1.029 0.626 0.920 0.534 CB 1.610 89 residues pruned to eliminate duplicates Z: 71 68.283 2.296 1.020 0.653 0.914 0.629 CB 1.670 71 residues pruned to eliminate duplicates Z: 73 67.377 2.265 1.003 0.627 0.917 0.583 CB 1.695 73 residues pruned to eliminate duplicates Z: 77 64.309 2.275 0.905 0.629 0.934 0.605 CB 1.614 77 residues pruned to eliminate duplicates Z: 72 67.918 2.276 0.998 0.635 0.930 0.606 CB 1.679 72 residues pruned to eliminate duplicates Z: 72 65.128 2.303 0.967 0.635 0.930 0.549 CB 1.619 72 residues pruned to eliminate duplicates Z: 78 59.994 2.288 0.942 0.591 0.896 0.584 CB 1.573 78 residues pruned to eliminate duplicates Z: 82 76.114 2.327 1.132 0.639 0.914 0.642 CB 1.638 82 residues pruned to eliminate duplicates Z: 74 68.832 2.312 0.983 0.653 0.932 0.589 CB 1.636 74 residues pruned to eliminate duplicates Z: 45 45.296 2.228 0.814 0.646 0.955 0.636 CB 1.545 45 residues pruned to eliminate duplicates Z: 44 44.207 2.197 0.897 0.651 0.953 0.674 CB 1.474 44 residues pruned to eliminate duplicates Z: 74 60.253 2.249 0.959 0.582 0.945 0.616 CB 1.564 74 residues pruned to eliminate duplicates Z: 48 49.152 2.240 0.850 0.640 0.957 0.681 CB 1.586 48 residues pruned to eliminate duplicates Z: 83 75.411 2.343 1.060 0.627 0.915 0.598 CB 1.674 83 residues pruned to eliminate duplicates Z: 57 53.006 2.263 0.865 0.628 0.964 0.625 CB 1.543 57 residues pruned to eliminate duplicates Z: 72 71.140 2.282 1.113 0.646 0.930 0.690 CB 1.644 72 residues pruned to eliminate duplicates Z: 102 85.727 2.329 1.089 0.637 0.941 0.505 CB 1.639 102 residues pruned to eliminate duplicates Z: 83 81.005 2.319 1.127 0.634 0.963 0.659 CB 1.660 83 residues pruned to eliminate duplicates Z: 83 79.451 2.330 1.062 0.630 0.976 0.634 CB 1.657 83 residues pruned to eliminate duplicates Z: 103 81.568 2.315 1.084 0.641 0.931 0.598 CB 1.576 103 residues pruned to eliminate duplicates Z: 86 70.031 2.276 0.995 0.612 0.941 0.576 CB 1.600 86 residues pruned to eliminate duplicates Z: 46 44.029 2.172 0.895 0.603 0.933 0.622 CB 1.549 46 residues pruned to eliminate duplicates Z: 102 88.176 2.350 1.064 0.649 0.950 0.624 CB 1.656 102 residues pruned to eliminate duplicates Z: 72 69.508 2.301 1.005 0.632 0.930 0.620 CB 1.699 72 residues pruned to eliminate duplicates Z: 84 78.019 2.325 1.103 0.643 0.928 0.614 CB 1.652 84 residues pruned to eliminate duplicates Z: 84 75.036 2.307 1.017 0.636 0.940 0.627 CB 1.658 84 residues pruned to eliminate duplicates Z: 70 72.437 2.324 1.064 0.669 0.928 0.623 CB 1.677 70 residues pruned to eliminate duplicates Z: 119 84.683 2.314 1.049 0.618 0.941 0.559 CB 1.563 119 residues pruned to eliminate duplicates Z: 84 75.223 2.322 1.040 0.620 0.940 0.590 CB 1.655 84 residues pruned to eliminate duplicates Z: 90 67.409 2.270 0.865 0.619 0.933 0.551 CB 1.617 90 residues pruned to eliminate duplicates Z: 89 75.165 2.299 1.094 0.616 0.932 0.580 CB 1.601 89 residues pruned to eliminate duplicates Z: 84 74.362 2.310 1.044 0.620 0.940 0.566 CB 1.643 84 residues pruned to eliminate duplicates Z: 88 71.934 2.303 0.991 0.616 0.943 0.552 CB 1.600 88 residues pruned to eliminate duplicates Z: 72 60.844 2.275 0.913 0.649 0.944 0.648 CB 1.531 72 residues pruned to eliminate duplicates Z: 33 33.590 2.263 0.678 0.516 1.000 0.531 CB 1.539 33 residues pruned to eliminate duplicates Z: 94 74.198 2.244 1.105 0.586 0.914 0.527 CB 1.641 94 residues pruned to eliminate duplicates Z: 72 61.343 2.247 1.023 0.596 0.958 0.577 CB 1.526 72 residues pruned to eliminate duplicates Z: 89 67.423 2.279 0.958 0.612 0.909 0.591 CB 1.592 89 residues pruned to eliminate duplicates Z: 82 76.907 2.329 1.063 0.635 0.951 0.605 CB 1.649 82 residues pruned to eliminate duplicates Z: 88 72.296 2.266 1.039 0.607 0.931 0.563 CB 1.627 88 residues pruned to eliminate duplicates Z: 72 68.955 2.313 1.122 0.634 0.887 0.620 CB 1.657 72 residues pruned to eliminate duplicates Z: 166 82.045 2.227 0.927 0.553 0.897 0.582 CB 1.576 166 residues pruned to eliminate duplicates Z: 70 71.407 2.302 1.025 0.672 0.942 0.565 CB 1.670 70 residues pruned to eliminate duplicates Z: 113 92.083 2.337 1.133 0.631 0.938 0.571 CB 1.647 113 residues pruned to eliminate duplicates Z: 83 71.115 2.311 1.039 0.637 0.902 0.634 CB 1.624 83 residues pruned to eliminate duplicates Z: 14 17.393 2.070 1.169 0.452 0.846 0.615 CB 1.334 14 residues pruned to eliminate duplicates Z: 86 71.584 2.289 1.020 0.612 0.941 0.588 CB 1.605 86 residues pruned to eliminate duplicates Z: 86 66.992 2.301 1.023 0.605 0.882 0.624 CB 1.601 86 residues pruned to eliminate duplicates Z: 8 9.652 1.841 1.001 0.241 0.857 0.571 N 1.559 8 residues pruned to eliminate duplicates Z: 19 21.179 2.180 0.899 0.568 0.833 0.667 CB 1.355 19 residues pruned to eliminate duplicates Z: 13 26.756 2.343 1.227 0.542 0.917 0.667 CB 1.550 13 residues pruned to eliminate duplicates Z: 87 75.005 2.289 1.107 0.623 0.919 0.570 CB 1.625 87 residues pruned to eliminate duplicates Z: 14 24.120 2.306 1.077 0.472 0.923 0.615 CB 1.556 14 residues pruned to eliminate duplicates Z: 80 68.026 2.172 1.073 0.658 0.949 0.734 CB 1.546 80 residues pruned to eliminate duplicates Z: 16 20.623 2.250 0.779 0.403 0.867 0.533 CB 1.700 16 residues pruned to eliminate duplicates Z: 85 73.418 2.300 1.058 0.608 0.929 0.571 CB 1.645 85 residues pruned to eliminate duplicates Z: 15 23.312 2.229 0.900 0.533 0.929 0.429 CB 1.534 15 residues pruned to eliminate duplicates Z: 19 24.994 2.246 0.955 0.458 0.889 0.611 CB 1.575 19 residues pruned to eliminate duplicates Z: 19 26.120 2.227 1.021 0.475 0.889 0.556 CB 1.577 19 residues pruned to eliminate duplicates Z: 119 88.016 2.311 1.123 0.616 0.924 0.585 CB 1.602 119 residues pruned to eliminate duplicates Z: 20 23.981 2.188 0.993 0.562 0.842 0.579 CB 1.411 20 residues pruned to eliminate duplicates Z: 10 10.976 2.114 0.540 0.571 0.778 0.556 CB 1.350 10 residues pruned to eliminate duplicates Z: 8 10.921 1.959 0.873 0.591 0.714 0.571 CA 1.444 7 residues pruned to eliminate duplicates Z: 12 18.225 1.873 0.989 0.722 0.909 0.545 CA 1.328 12 residues pruned to eliminate duplicates Z: 91 64.707 2.145 0.900 0.640 0.933 0.633 CB 1.572 91 residues pruned to eliminate duplicates Z: 48 48.590 2.123 1.020 0.626 0.936 0.745 CB 1.568 48 residues pruned to eliminate duplicates Z: 89 65.913 2.162 0.975 0.648 0.920 0.705 CB 1.558 89 residues pruned to eliminate duplicates Z: 145 82.221 2.116 0.976 0.621 0.965 0.653 CB 1.514 145 residues pruned to eliminate duplicates Z: 69 61.045 2.165 0.979 0.661 0.971 0.676 CB 1.533 69 residues pruned to eliminate duplicates Z: 129 72.026 2.114 0.945 0.622 0.898 0.648 CB 1.537 129 residues pruned to eliminate duplicates Z: 41 43.776 2.096 1.080 0.645 0.925 0.700 CB 1.500 41 residues pruned to eliminate duplicates Z: 68 62.621 2.196 0.935 0.629 0.970 0.612 CB 1.643 68 residues pruned to eliminate duplicates Z: 71 60.088 2.127 0.948 0.616 0.971 0.657 CB 1.598 71 residues pruned to eliminate duplicates Z: 116 79.390 2.152 1.035 0.649 0.957 0.678 CB 1.537 116 residues pruned to eliminate duplicates Z: 117 78.278 2.164 0.993 0.645 0.966 0.638 CB 1.524 117 residues pruned to eliminate duplicates Z: 159 76.850 2.089 0.916 0.598 0.937 0.658 CB 1.486 159 residues pruned to eliminate duplicates Z: 84 70.042 2.196 0.939 0.657 0.976 0.699 CB 1.598 84 residues pruned to eliminate duplicates Z: 45 40.796 2.158 0.762 0.629 0.932 0.682 CB 1.538 45 residues pruned to eliminate duplicates Z: 122 76.875 2.143 1.038 0.637 0.934 0.645 CB 1.507 122 residues pruned to eliminate duplicates Z: 74 54.667 2.145 0.762 0.608 0.959 0.630 CB 1.593 74 residues pruned to eliminate duplicates Z: 83 65.223 2.173 0.916 0.614 0.951 0.622 CB 1.632 83 residues pruned to eliminate duplicates Z: 73 56.329 2.141 0.896 0.617 0.944 0.625 CB 1.551 73 residues pruned to eliminate duplicates Z: 88 68.656 2.181 0.937 0.654 0.943 0.609 CB 1.602 88 residues pruned to eliminate duplicates Z: 48 49.920 2.225 0.853 0.650 0.957 0.660 CB 1.603 48 residues pruned to eliminate duplicates Z: 42 51.173 2.190 1.039 0.639 0.976 0.659 CB 1.610 42 residues pruned to eliminate duplicates Z: 88 66.685 2.169 0.915 0.650 0.943 0.667 CB 1.587 88 residues pruned to eliminate duplicates Z: 46 48.382 2.245 0.915 0.628 0.911 0.622 CB 1.632 46 residues pruned to eliminate duplicates Z: 47 46.833 2.203 1.039 0.609 0.870 0.522 CB 1.594 47 residues pruned to eliminate duplicates Z: 70 62.438 2.174 1.012 0.640 0.942 0.652 CB 1.600 70 residues pruned to eliminate duplicates Z: 143 79.782 2.116 0.999 0.632 0.930 0.676 CB 1.504 143 residues pruned to eliminate duplicates Z: 86 65.120 2.166 0.987 0.644 0.918 0.659 CB 1.563 86 residues pruned to eliminate duplicates Z: 50 42.768 2.187 0.917 0.604 0.857 0.592 CB 1.539 50 residues pruned to eliminate duplicates Z: 89 56.699 2.103 0.943 0.578 0.920 0.659 CB 1.490 89 residues pruned to eliminate duplicates Z: 88 63.432 2.133 0.984 0.642 0.908 0.713 CB 1.550 88 residues pruned to eliminate duplicates Z: 71 68.054 2.186 1.043 0.671 0.971 0.657 CB 1.601 71 residues pruned to eliminate duplicates Z: 88 65.782 2.165 0.967 0.628 0.943 0.655 CB 1.558 88 residues pruned to eliminate duplicates Z: 85 69.456 2.192 0.989 0.667 0.940 0.726 CB 1.584 85 residues pruned to eliminate duplicates Z: 67 65.190 2.209 0.934 0.658 0.985 0.652 CB 1.647 67 residues pruned to eliminate duplicates Z: 86 68.464 2.182 1.028 0.639 0.929 0.671 CB 1.585 86 residues pruned to eliminate duplicates Z: 85 69.726 2.185 1.041 0.657 0.940 0.690 CB 1.568 85 residues pruned to eliminate duplicates Z: 84 67.436 2.186 1.012 0.662 0.940 0.627 CB 1.541 84 residues pruned to eliminate duplicates Z: 117 80.796 2.156 1.019 0.654 0.983 0.698 CB 1.519 117 residues pruned to eliminate duplicates Z: 63 61.562 2.200 1.008 0.655 0.935 0.677 CB 1.637 63 residues pruned to eliminate duplicates Z: 67 63.889 2.191 0.936 0.663 0.985 0.667 CB 1.618 67 residues pruned to eliminate duplicates Z: 15 12.764 1.940 0.902 0.502 0.714 0.571 CB 1.292 15 residues pruned to eliminate duplicates Z: 21 16.323 2.001 0.476 0.466 0.900 0.550 CB 1.422 21 residues pruned to eliminate duplicates Z: 141 79.038 2.134 1.004 0.621 0.936 0.650 CB 1.489 141 residues pruned to eliminate duplicates Z: 18 19.698 2.057 0.627 0.459 1.000 0.588 CB 1.490 18 residues pruned to eliminate duplicates Z: 19 20.159 2.079 0.625 0.487 0.944 0.611 CA 1.509 19 residues pruned to eliminate duplicates Z: 89 65.917 2.161 0.952 0.638 0.932 0.648 CB 1.571 89 residues pruned to eliminate duplicates Z: 26 27.377 2.125 0.753 0.520 0.880 0.560 CB 1.637 26 residues pruned to eliminate duplicates Z: 18 20.661 2.034 0.622 0.517 0.941 0.529 CB 1.586 18 residues pruned to eliminate duplicates Z: 72 63.298 2.181 0.956 0.632 0.958 0.690 CB 1.624 72 residues pruned to eliminate duplicates Z: 84 71.885 2.194 1.014 0.665 0.964 0.723 CB 1.589 84 residues pruned to eliminate duplicates Z: 90 66.693 2.170 1.041 0.617 0.910 0.640 CB 1.570 95 residues pruned to eliminate duplicates Z: 7 3.354 1.261 0.522 0.463 0.833 0.667 CB 0.889 Z: 14 29.292 2.264 0.658 0.857 1.000 0.846 CB 1.595 14 residues pruned to eliminate duplicates Z: 16 29.330 2.187 1.041 0.734 0.867 0.667 CA 1.586 16 residues pruned to eliminate duplicates Z: 88 62.486 2.171 0.873 0.631 0.943 0.598 CB 1.546 88 residues pruned to eliminate duplicates Z: 144 78.614 2.131 0.884 0.622 0.958 0.594 CB 1.524 144 residues pruned to eliminate duplicates Z: 89 61.483 2.174 0.930 0.614 0.898 0.614 CB 1.563 89 residues pruned to eliminate duplicates Z: 44 39.015 2.067 1.075 0.571 0.930 0.372 CB 1.392 44 residues pruned to eliminate duplicates Z: 21 6.206 1.654 0.214 0.205 0.750 0.400 CB 1.308 21 residues pruned to eliminate duplicates Z: 17 13.642 1.864 0.431 0.378 1.000 0.750 CB 1.456 20 residues pruned to eliminate duplicates Z: 6 4.394 1.444 0.583 0.287 1.000 0.600 CB 1.093 6 residues pruned to eliminate duplicates Z: 86 44.266 2.002 0.744 0.552 0.918 0.624 CB 1.424 86 residues pruned to eliminate duplicates Z: 18 9.256 1.814 0.311 0.301 0.882 0.588 CB 1.336 18 residues pruned to eliminate duplicates Z: 129 63.926 2.059 0.860 0.602 0.906 0.695 CB 1.477 129 residues pruned to eliminate duplicates Z: 16 9.742 1.779 0.376 0.309 0.933 0.467 CB 1.362 16 residues pruned to eliminate duplicates Z: 42 18.492 1.885 0.458 0.475 0.805 0.585 CB 1.339 42 residues pruned to eliminate duplicates Z: 15 8.672 1.799 0.417 0.303 0.857 0.500 CB 1.321 15 residues pruned to eliminate duplicates Z: 92 48.591 2.043 0.821 0.535 0.923 0.571 CB 1.433 92 residues pruned to eliminate duplicates Z: 14 12.721 1.955 0.639 0.287 0.923 0.538 CB 1.515 14 residues pruned to eliminate duplicates Z: 15 12.858 1.843 0.725 0.331 0.929 0.643 CB 1.400 15 residues pruned to eliminate duplicates Z: 16 11.844 1.898 0.682 0.329 0.867 0.600 CA 1.334 16 residues pruned to eliminate duplicates Z: 41 25.146 1.910 0.605 0.479 0.950 0.625 CB 1.394 41 residues pruned to eliminate duplicates Z: 29 23.573 1.986 0.569 0.574 0.929 0.643 CB 1.433 29 residues pruned to eliminate duplicates Z: 69 51.225 2.084 0.863 0.640 0.941 0.662 CB 1.492 69 residues pruned to eliminate duplicates Z: 27 20.658 1.948 0.603 0.557 0.885 0.654 CB 1.388 27 residues pruned to eliminate duplicates Z: 88 49.049 2.029 0.784 0.562 0.966 0.632 CB 1.416 88 residues pruned to eliminate duplicates Z: 94 50.181 2.014 0.840 0.548 0.935 0.656 CB 1.433 94 residues pruned to eliminate duplicates Z: 78 38.590 1.951 0.742 0.501 0.935 0.519 CB 1.383 78 residues pruned to eliminate duplicates Z: 149 78.363 2.110 0.918 0.611 0.946 0.608 CB 1.514 149 residues pruned to eliminate duplicates Z: 140 75.932 2.149 0.859 0.616 0.928 0.662 CB 1.556 140 residues pruned to eliminate duplicates Z: 162 75.532 2.138 0.878 0.583 0.925 0.627 CB 1.479 162 residues pruned to eliminate duplicates Z: 88 53.524 2.037 0.858 0.579 0.966 0.655 CB 1.455 87 residues pruned to eliminate duplicates Z: 14 19.554 1.979 0.575 0.841 0.923 0.769 CB 1.406 14 residues pruned to eliminate duplicates Z: 141 74.772 2.110 0.865 0.605 0.950 0.643 CB 1.530 141 residues pruned to eliminate duplicates Z: 61 40.006 2.033 0.814 0.562 0.933 0.567 CB 1.413 61 residues pruned to eliminate duplicates Z: 132 71.472 2.133 0.894 0.616 0.901 0.664 CB 1.537 132 residues pruned to eliminate duplicates Z: 160 75.363 2.099 0.837 0.612 0.931 0.660 CB 1.498 160 residues pruned to eliminate duplicates Z: 156 77.700 2.105 0.876 0.597 0.948 0.606 CB 1.520 161 residues pruned to eliminate duplicates Z: 15 21.100 1.902 0.537 0.776 1.000 0.786 CA 1.511 15 residues pruned to eliminate duplicates Z: 160 76.596 2.093 0.864 0.597 0.950 0.629 CB 1.494 160 residues pruned to eliminate duplicates Z: 157 73.705 2.093 0.880 0.581 0.936 0.583 CB 1.483 157 residues pruned to eliminate duplicates Z: 150 79.603 2.124 0.868 0.608 0.953 0.638 CB 1.556 150 residues pruned to eliminate duplicates Z: 121 74.289 2.149 0.972 0.617 0.942 0.625 CB 1.521 121 residues pruned to eliminate duplicates Z: 157 74.923 2.087 0.872 0.581 0.936 0.628 CB 1.517 157 residues pruned to eliminate duplicates Z: 122 71.072 2.137 0.941 0.611 0.917 0.587 CB 1.529 122 residues pruned to eliminate duplicates 806 residues left after pruning, divided into chains as follows: A: 12 B: 24 C: 112 D: 16 E: 20 F: 8 G: 107 H: 121 I: 231 J: 155 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 37.49 % ------------------------------------------------------------------------------ Global autotracing cycle 3 = 0.300, Contrast = 0.502, Connect. = 0.737 for dens.mod. cycle 1 = 0.300, Contrast = 0.574, Connect. = 0.761 for dens.mod. cycle 2 = 0.300, Contrast = 0.682, Connect. = 0.791 for dens.mod. cycle 3 = 0.300, Contrast = 0.686, Connect. = 0.791 for dens.mod. cycle 4 = 0.300, Contrast = 0.696, Connect. = 0.792 for dens.mod. cycle 5 = 0.300, Contrast = 0.699, Connect. = 0.793 for dens.mod. cycle 6 = 0.300, Contrast = 0.704, Connect. = 0.794 for dens.mod. cycle 7 = 0.300, Contrast = 0.706, Connect. = 0.795 for dens.mod. cycle 8 = 0.300, Contrast = 0.708, Connect. = 0.796 for dens.mod. cycle 9 = 0.300, Contrast = 0.709, Connect. = 0.796 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 6515 peaks > 0.5 sigma used to seed fragment search Space for about 1274 unique residues taking solvent into account 1280 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 17 41.454 2.375 1.094 0.924 0.875 0.688 CB 1.673 B: 14 37.837 2.363 0.986 0.911 0.923 0.615 CB 1.716 C: 14 27.458 2.347 0.621 0.902 1.000 0.846 CA 1.427 D: 18 42.031 2.304 1.074 0.921 0.941 0.706 CB 1.595 17 residues pruned to eliminate duplicates E: 17 36.722 2.276 0.860 0.933 0.938 0.750 CB 1.614 17 residues pruned to eliminate duplicates F: 14 35.730 2.342 0.842 0.906 1.000 0.846 CA 1.633 G: 17 36.531 2.282 0.836 0.918 0.938 0.750 CB 1.640 H: 14 44.223 2.362 1.149 0.888 1.000 0.846 CA 1.740 14 residues pruned to eliminate duplicates I: 15 47.091 2.475 1.168 0.932 1.000 0.857 CB 1.638 17 residues pruned to eliminate duplicates J: 14 43.519 2.361 1.177 0.887 0.923 0.692 CA 1.833 14 residues pruned to eliminate duplicates K: 14 41.898 2.434 0.849 0.905 1.000 0.769 CA 1.838 14 residues pruned to eliminate duplicates L: 15 35.890 2.257 0.914 0.910 0.929 0.786 CA 1.696 14 residues pruned to eliminate duplicates M: 14 39.887 2.302 1.179 0.811 1.000 0.692 CA 1.682 14 residues pruned to eliminate duplicates N: 13 49.832 2.468 1.230 0.895 1.000 0.750 CA 1.874 15 residues pruned to eliminate duplicates O: 13 43.513 2.460 0.863 0.905 1.000 0.833 CA 1.951 14 residues pruned to eliminate duplicates P: 13 42.614 2.487 1.121 0.900 0.917 0.833 CA 1.817 13 residues pruned to eliminate duplicates Q: 15 45.853 2.373 1.092 0.927 1.000 0.857 CB 1.730 R: 17 37.266 2.259 0.788 0.915 1.000 0.875 CB 1.630 17 residues pruned to eliminate duplicates S: 14 36.103 2.368 0.885 0.912 0.923 0.769 CA 1.721 14 residues pruned to eliminate duplicates T: 16 46.758 2.453 1.034 0.940 1.000 0.667 CB 1.680 15 residues pruned to eliminate duplicates U: 17 39.444 2.191 0.964 0.902 1.000 0.875 CB 1.634 18 residues pruned to eliminate duplicates V: 13 42.494 2.463 1.155 0.903 0.917 0.750 CB 1.797 13 residues pruned to eliminate duplicates W: 127 90.348 2.392 0.956 0.623 0.905 0.587 CB 1.693 30 residues pruned to eliminate duplicates X: 15 29.630 2.390 0.749 0.801 0.929 0.500 CA 1.567 15 residues pruned to eliminate duplicates Y: 14 35.497 2.441 0.718 0.934 1.000 0.923 CA 1.637 Z: 14 37.425 2.341 0.974 0.864 1.000 0.769 CA 1.648 14 residues pruned to eliminate duplicates Z: 15 46.066 2.349 1.271 0.916 1.000 0.500 CA 1.630 14 residues pruned to eliminate duplicates Z: 14 37.163 2.411 1.026 0.856 0.923 0.462 CB 1.686 14 residues pruned to eliminate duplicates Z: 13 26.720 2.400 0.831 0.828 0.833 0.833 CA 1.586 13 residues pruned to eliminate duplicates Z: 17 39.244 2.280 0.997 0.912 0.938 0.812 CB 1.628 15 residues pruned to eliminate duplicates Z: 18 36.293 2.188 0.981 0.901 0.941 0.647 CB 1.540 17 residues pruned to eliminate duplicates Z: 13 39.448 2.534 0.589 0.916 1.000 0.833 CB 1.998 13 residues pruned to eliminate duplicates Z: 14 36.496 2.410 0.752 0.929 1.000 0.846 CB 1.677 14 residues pruned to eliminate duplicates Z: 32 53.196 2.451 1.131 0.628 0.935 0.581 CB 1.733 32 residues pruned to eliminate duplicates Z: 32 52.768 2.445 1.144 0.630 0.903 0.645 CB 1.771 32 residues pruned to eliminate duplicates Z: 59 67.315 2.360 1.080 0.614 0.966 0.621 CB 1.674 32 residues pruned to eliminate duplicates Z: 21 20.886 2.103 0.721 0.413 0.950 0.400 CB 1.488 Z: 14 36.536 2.427 1.074 0.924 0.923 0.923 CB 1.532 14 residues pruned to eliminate duplicates Z: 174 92.071 2.380 0.815 0.584 0.896 0.647 CB 1.669 115 residues pruned to eliminate duplicates Z: 15 34.629 2.241 0.700 0.921 0.929 0.929 CA 1.841 15 residues pruned to eliminate duplicates Z: 14 41.775 2.360 1.223 0.866 0.923 0.692 CA 1.752 14 residues pruned to eliminate duplicates Z: 14 37.907 2.253 1.016 0.831 1.000 0.692 CA 1.739 15 residues pruned to eliminate duplicates Z: 16 38.220 2.161 1.077 0.852 1.000 0.533 CA 1.626 16 residues pruned to eliminate duplicates Z: 17 36.393 2.363 0.874 0.750 1.000 0.562 CB 1.643 17 residues pruned to eliminate duplicates Z: 17 43.529 2.404 0.949 0.931 1.000 0.750 CB 1.622 17 residues pruned to eliminate duplicates Z: 15 26.085 2.199 0.668 0.850 0.857 0.786 CB 1.642 15 residues pruned to eliminate duplicates Z: 91 71.018 2.289 0.970 0.620 0.900 0.678 CB 1.648 13 residues pruned to eliminate duplicates Z: 9 23.517 2.328 0.595 0.910 1.000 1.000 CB 1.588 Z: 193 102.372 2.364 0.927 0.576 0.911 0.615 CB 1.654 203 residues pruned to eliminate duplicates Z: 136 87.156 2.302 1.015 0.595 0.911 0.541 CB 1.621 72 residues pruned to eliminate duplicates Z: 13 31.986 2.458 0.560 0.905 1.000 0.917 CA 1.714 13 residues pruned to eliminate duplicates Z: 36 46.376 2.348 1.107 0.594 0.857 0.714 CB 1.690 36 residues pruned to eliminate duplicates Z: 12 45.234 2.455 1.151 0.910 0.909 0.364 CA 2.015 12 residues pruned to eliminate duplicates Z: 13 17.467 1.974 0.316 0.825 1.000 0.667 CB 1.466 5 residues pruned to eliminate duplicates Z: 11 24.032 2.159 0.694 0.916 1.000 0.700 CB 1.466 Z: 16 41.258 2.362 0.955 0.897 1.000 0.933 CB 1.651 16 residues pruned to eliminate duplicates Z: 15 33.821 2.333 0.683 0.923 1.000 0.786 CB 1.617 15 residues pruned to eliminate duplicates Z: 91 48.914 2.268 0.748 0.437 0.889 0.556 CB 1.561 79 residues pruned to eliminate duplicates Z: 85 74.557 2.300 1.037 0.642 0.929 0.583 CB 1.638 86 residues pruned to eliminate duplicates Z: 9 29.574 2.228 1.232 0.835 1.000 0.875 CA 1.575 9 residues pruned to eliminate duplicates Z: 188 101.205 2.364 0.931 0.593 0.898 0.658 CB 1.650 188 residues pruned to eliminate duplicates Z: 9 19.415 2.277 0.657 0.821 0.875 0.750 CB 1.573 9 residues pruned to eliminate duplicates Z: 139 92.110 2.392 0.957 0.620 0.891 0.623 CB 1.678 143 residues pruned to eliminate duplicates Z: 10 17.481 2.168 1.168 0.391 0.889 0.778 CA 1.565 10 residues pruned to eliminate duplicates Z: 14 34.582 2.358 0.876 0.866 0.923 0.769 CA 1.719 14 residues pruned to eliminate duplicates Z: 13 36.462 2.281 0.933 0.892 1.000 0.833 CB 1.715 Z: 13 38.954 2.491 0.673 0.902 1.000 0.917 CA 1.925 13 residues pruned to eliminate duplicates Z: 16 31.422 2.031 1.158 0.916 0.933 0.667 CB 1.400 Z: 13 26.885 2.315 0.983 0.513 1.000 0.583 CB 1.669 13 residues pruned to eliminate duplicates Z: 15 39.725 2.345 0.855 0.946 1.000 0.714 CB 1.687 15 residues pruned to eliminate duplicates Z: 13 42.487 2.423 1.128 0.881 0.917 0.833 CA 1.879 13 residues pruned to eliminate duplicates Z: 15 24.506 2.145 0.740 0.868 0.929 0.857 CA 1.381 Z: 10 20.508 2.180 0.508 0.879 1.000 0.778 CB 1.507 10 residues pruned to eliminate duplicates Z: 15 30.030 2.296 0.748 0.902 0.929 0.786 CA 1.537 15 residues pruned to eliminate duplicates Z: 17 41.335 2.251 0.994 0.911 1.000 0.812 CB 1.632 17 residues pruned to eliminate duplicates Z: 12 47.952 2.680 1.095 0.921 0.909 0.909 CA 1.994 12 residues pruned to eliminate duplicates Z: 16 40.448 2.211 1.082 0.925 1.000 0.800 CB 1.593 16 residues pruned to eliminate duplicates Z: 10 26.063 2.338 0.677 0.928 1.000 0.889 CB 1.552 10 residues pruned to eliminate duplicates Z: 14 22.030 1.952 1.055 0.776 0.769 0.538 CB 1.551 Z: 13 31.928 2.180 0.974 0.868 0.917 0.667 CB 1.709 13 residues pruned to eliminate duplicates Z: 10 12.261 2.048 1.120 0.559 0.778 0.667 CB 1.142 10 residues pruned to eliminate duplicates Z: 92 71.236 2.271 0.968 0.641 0.901 0.538 CB 1.625 92 residues pruned to eliminate duplicates Z: 16 37.558 2.314 1.089 0.922 0.933 0.800 CA 1.512 16 residues pruned to eliminate duplicates Z: 115 72.645 2.373 0.874 0.531 0.921 0.649 CB 1.610 115 residues pruned to eliminate duplicates Z: 65 40.031 2.234 0.834 0.453 0.828 0.641 CB 1.547 65 residues pruned to eliminate duplicates Z: 14 26.553 2.268 0.912 0.926 0.923 0.769 CB 1.290 14 residues pruned to eliminate duplicates Z: 90 71.763 2.304 0.941 0.629 0.944 0.652 CB 1.597 85 residues pruned to eliminate duplicates Z: 10 15.911 2.314 -0.001 0.916 1.000 1.000 CB 1.621 10 residues pruned to eliminate duplicates Z: 17 35.540 2.256 0.659 0.944 1.000 0.875 CB 1.644 17 residues pruned to eliminate duplicates Z: 16 32.751 2.125 1.051 0.864 0.867 0.533 CA 1.641 16 residues pruned to eliminate duplicates Z: 24 22.084 2.241 0.680 0.317 0.913 0.522 CB 1.640 24 residues pruned to eliminate duplicates Z: 13 34.615 2.195 0.857 0.880 1.000 0.667 CA 1.776 13 residues pruned to eliminate duplicates Z: 16 39.441 2.311 1.137 0.949 1.000 0.933 CB 1.423 16 residues pruned to eliminate duplicates Z: 17 41.594 2.256 0.942 0.924 1.000 0.812 CB 1.667 17 residues pruned to eliminate duplicates Z: 14 26.093 2.398 0.726 0.893 0.846 0.462 CB 1.483 14 residues pruned to eliminate duplicates Z: 18 35.411 2.205 0.775 0.910 0.941 0.824 CB 1.653 18 residues pruned to eliminate duplicates Z: 116 85.363 2.357 0.997 0.597 0.957 0.617 CB 1.611 116 residues pruned to eliminate duplicates Z: 18 42.085 2.241 1.268 0.827 0.941 0.706 CB 1.607 14 residues pruned to eliminate duplicates Z: 13 46.773 2.443 1.047 0.924 1.000 0.750 CA 1.897 13 residues pruned to eliminate duplicates Z: 33 48.213 2.356 1.076 0.617 0.875 0.594 CB 1.783 34 residues pruned to eliminate duplicates Z: 48 46.740 2.134 0.960 0.652 0.979 0.745 CB 1.445 44 residues pruned to eliminate duplicates Z: 11 21.382 2.150 0.731 0.913 1.000 0.900 CB 1.286 11 residues pruned to eliminate duplicates Z: 11 14.541 2.134 0.287 0.787 0.900 0.700 CA 1.446 11 residues pruned to eliminate duplicates Z: 50 48.995 2.304 1.048 0.528 0.918 0.551 CB 1.572 50 residues pruned to eliminate duplicates Z: 12 38.897 2.264 1.254 0.917 1.000 0.909 CB 1.622 13 residues pruned to eliminate duplicates Z: 16 42.453 2.344 1.046 0.927 1.000 0.600 CB 1.602 16 residues pruned to eliminate duplicates Z: 14 28.990 2.244 1.095 0.932 0.923 0.769 CB 1.294 14 residues pruned to eliminate duplicates Z: 59 49.684 2.223 0.781 0.647 0.966 0.690 CB 1.489 59 residues pruned to eliminate duplicates Z: 74 66.855 2.297 1.009 0.629 0.918 0.548 CB 1.637 74 residues pruned to eliminate duplicates Z: 13 37.003 2.246 1.108 0.888 1.000 0.917 CB 1.626 12 residues pruned to eliminate duplicates Z: 11 19.167 1.994 0.981 0.494 1.000 0.500 N 1.543 11 residues pruned to eliminate duplicates Z: 11 18.140 1.887 0.669 0.894 1.000 0.900 CB 1.307 Z: 11 21.673 1.978 1.016 0.772 1.000 0.600 CA 1.351 11 residues pruned to eliminate duplicates Z: 18 44.093 2.139 1.343 0.899 0.941 0.882 CB 1.621 19 residues pruned to eliminate duplicates Z: 14 39.991 2.306 1.134 0.897 0.923 0.846 CA 1.748 14 residues pruned to eliminate duplicates Z: 67 62.210 2.271 0.965 0.636 0.939 0.636 CB 1.608 67 residues pruned to eliminate duplicates Z: 17 42.278 2.212 1.233 0.931 0.938 0.750 CA 1.595 17 residues pruned to eliminate duplicates Z: 30 52.387 2.410 1.014 0.706 0.966 0.552 CB 1.721 30 residues pruned to eliminate duplicates Z: 12 56.081 2.649 1.245 0.922 1.000 0.636 CA 1.999 12 residues pruned to eliminate duplicates Z: 35 45.733 2.344 1.121 0.584 0.882 0.618 CB 1.650 35 residues pruned to eliminate duplicates Z: 8 8.283 2.028 0.976 0.224 0.714 0.571 CB 1.510 Z: 13 41.966 2.432 0.959 0.905 1.000 0.750 CA 1.810 13 residues pruned to eliminate duplicates Z: 15 14.694 2.157 0.775 0.265 0.857 0.500 CB 1.565 8 residues pruned to eliminate duplicates Z: 14 41.890 2.442 0.905 0.933 1.000 0.769 CB 1.743 14 residues pruned to eliminate duplicates Z: 17 46.552 2.288 1.213 0.947 0.938 0.812 CA 1.695 17 residues pruned to eliminate duplicates Z: 145 104.322 2.414 0.990 0.614 0.944 0.632 CB 1.720 147 residues pruned to eliminate duplicates Z: 18 38.798 2.300 1.058 0.864 0.941 0.765 CB 1.548 18 residues pruned to eliminate duplicates Z: 16 48.145 2.319 1.183 0.950 1.000 0.867 CA 1.694 17 residues pruned to eliminate duplicates Z: 18 35.668 2.141 0.833 0.900 1.000 0.706 CA 1.575 18 residues pruned to eliminate duplicates Z: 50 43.632 2.077 0.863 0.634 0.939 0.449 CB 1.513 16 residues pruned to eliminate duplicates Z: 16 42.235 2.310 1.040 0.931 1.000 0.933 CB 1.617 16 residues pruned to eliminate duplicates Z: 95 59.480 2.336 0.782 0.505 0.904 0.543 CB 1.621 95 residues pruned to eliminate duplicates Z: 121 80.385 2.222 0.990 0.632 0.925 0.650 CB 1.585 79 residues pruned to eliminate duplicates Z: 24 15.667 2.206 0.528 0.351 0.739 0.435 CB 1.541 24 residues pruned to eliminate duplicates Z: 17 37.196 2.326 1.063 0.798 0.875 0.562 CA 1.706 17 residues pruned to eliminate duplicates Z: 93 84.832 2.392 1.029 0.633 0.935 0.598 CB 1.722 93 residues pruned to eliminate duplicates Z: 9 14.886 2.180 0.848 0.718 0.750 0.500 CB 1.429 9 residues pruned to eliminate duplicates Z: 17 37.438 2.264 0.845 0.887 1.000 0.688 CB 1.615 17 residues pruned to eliminate duplicates Z: 15 28.684 2.145 0.953 0.907 0.929 0.786 CA 1.400 15 residues pruned to eliminate duplicates Z: 14 44.906 2.367 1.241 0.894 0.923 0.615 CA 1.825 14 residues pruned to eliminate duplicates Z: 23 16.713 2.018 0.556 0.389 0.909 0.545 CB 1.403 Z: 12 15.368 1.986 0.550 0.855 1.000 0.727 CB 1.111 12 residues pruned to eliminate duplicates Z: 10 16.922 2.054 0.734 0.731 1.000 0.778 CA 1.287 10 residues pruned to eliminate duplicates Z: 18 32.671 2.154 0.851 0.836 0.941 0.471 CA 1.580 18 residues pruned to eliminate duplicates Z: 15 36.573 2.188 1.050 0.914 1.000 0.714 CB 1.542 15 residues pruned to eliminate duplicates Z: 13 28.319 2.240 0.819 0.906 0.917 0.833 CA 1.556 13 residues pruned to eliminate duplicates Z: 16 35.749 2.407 0.922 0.748 0.933 0.733 CA 1.713 16 residues pruned to eliminate duplicates Z: 15 28.227 2.258 0.503 0.917 1.000 0.857 CA 1.568 15 residues pruned to eliminate duplicates Z: 17 45.150 2.262 1.022 0.935 1.000 0.812 CA 1.720 17 residues pruned to eliminate duplicates Z: 143 84.988 2.277 0.901 0.619 0.944 0.599 CB 1.560 143 residues pruned to eliminate duplicates Z: 14 14.608 1.858 0.603 0.799 0.769 0.692 CB 1.361 17 residues pruned to eliminate duplicates Z: 120 87.919 2.332 1.063 0.620 0.933 0.622 CB 1.604 106 residues pruned to eliminate duplicates Z: 12 14.027 1.673 0.909 0.787 0.909 0.636 CB 1.131 12 residues pruned to eliminate duplicates Z: 137 83.252 2.400 0.902 0.558 0.904 0.669 CB 1.634 137 residues pruned to eliminate duplicates Z: 11 14.121 1.981 0.741 0.732 0.800 0.700 CA 1.313 11 residues pruned to eliminate duplicates Z: 12 12.646 2.025 0.735 0.425 0.909 0.455 CB 1.291 12 residues pruned to eliminate duplicates Z: 89 69.269 2.288 0.917 0.643 0.943 0.591 CB 1.561 89 residues pruned to eliminate duplicates Z: 10 17.335 2.048 0.898 0.749 0.889 0.667 CA 1.339 10 residues pruned to eliminate duplicates Z: 53 33.338 2.136 0.730 0.424 0.904 0.596 CB 1.499 62 residues pruned to eliminate duplicates Z: 144 97.319 2.408 0.929 0.599 0.937 0.629 CB 1.701 144 residues pruned to eliminate duplicates Z: 83 73.014 2.303 1.046 0.638 0.927 0.598 CB 1.622 83 residues pruned to eliminate duplicates Z: 11 13.353 1.834 0.641 0.771 0.900 0.700 CA 1.227 11 residues pruned to eliminate duplicates Z: 9 20.087 2.219 1.250 0.768 0.875 0.750 CB 1.282 8 residues pruned to eliminate duplicates Z: 15 32.221 2.379 0.784 0.859 0.929 0.643 CA 1.609 15 residues pruned to eliminate duplicates Z: 14 24.089 2.126 0.743 0.850 0.923 0.692 CA 1.447 14 residues pruned to eliminate duplicates Z: 17 25.875 2.126 0.588 0.860 0.938 0.750 CB 1.503 17 residues pruned to eliminate duplicates Z: 10 19.413 2.090 0.864 0.837 0.889 0.778 CA 1.398 10 residues pruned to eliminate duplicates Z: 15 44.510 2.196 1.192 0.892 1.000 0.571 CA 1.775 15 residues pruned to eliminate duplicates Z: 9 16.180 2.388 0.252 0.847 0.875 0.625 CB 1.623 9 residues pruned to eliminate duplicates Z: 90 65.001 2.171 0.852 0.631 0.955 0.607 CB 1.586 90 residues pruned to eliminate duplicates Z: 10 15.822 2.046 0.460 0.763 1.000 0.667 CA 1.398 10 residues pruned to eliminate duplicates Z: 68 67.931 2.230 1.021 0.691 0.955 0.716 CB 1.618 68 residues pruned to eliminate duplicates Z: 9 14.972 2.178 0.709 0.762 0.875 0.375 CB 1.287 9 residues pruned to eliminate duplicates Z: 32 43.621 2.235 1.033 0.702 0.903 0.613 CB 1.588 32 residues pruned to eliminate duplicates Z: 10 27.485 2.332 0.616 0.914 1.000 1.000 CB 1.719 10 residues pruned to eliminate duplicates Z: 12 15.640 1.966 0.425 0.912 0.909 0.727 CB 1.311 12 residues pruned to eliminate duplicates Z: 19 18.485 2.110 0.654 0.410 0.833 0.389 CA 1.647 19 residues pruned to eliminate duplicates Z: 13 20.895 2.130 1.143 0.555 0.750 0.500 CB 1.671 13 residues pruned to eliminate duplicates Z: 16 33.308 2.179 0.968 0.907 1.000 0.733 CA 1.425 16 residues pruned to eliminate duplicates Z: 79 54.385 2.365 0.799 0.496 0.885 0.603 CB 1.642 79 residues pruned to eliminate duplicates Z: 15 35.147 2.196 1.151 0.853 1.000 0.500 CA 1.470 15 residues pruned to eliminate duplicates Z: 10 25.589 2.247 0.662 0.924 1.000 0.778 CB 1.604 10 residues pruned to eliminate duplicates Z: 167 87.094 2.229 0.954 0.577 0.916 0.584 CB 1.574 308 residues pruned to eliminate duplicates Z: 15 33.827 2.335 0.942 0.847 0.929 0.857 CA 1.594 Z: 9 25.660 2.340 0.629 0.908 1.000 0.750 CB 1.690 Z: 13 17.192 1.893 0.389 0.808 1.000 0.750 CA 1.443 13 residues pruned to eliminate duplicates Z: 18 43.426 2.117 1.184 0.898 1.000 0.765 CA 1.630 18 residues pruned to eliminate duplicates Z: 17 34.889 2.335 0.638 0.915 1.000 0.812 CB 1.611 17 residues pruned to eliminate duplicates Z: 13 39.567 2.390 1.294 0.902 0.833 0.667 CB 1.783 13 residues pruned to eliminate duplicates Z: 10 14.463 1.981 0.444 0.857 0.889 0.667 CB 1.397 11 residues pruned to eliminate duplicates Z: 16 25.035 2.128 0.638 0.903 0.933 0.800 CA 1.417 16 residues pruned to eliminate duplicates Z: 16 28.718 2.143 0.623 0.889 1.000 0.800 CB 1.535 16 residues pruned to eliminate duplicates Z: 55 60.963 2.317 1.002 0.636 0.926 0.593 CB 1.700 55 residues pruned to eliminate duplicates Z: 87 77.955 2.352 1.031 0.633 0.942 0.698 CB 1.649 87 residues pruned to eliminate duplicates Z: 10 20.875 2.013 0.720 0.877 1.000 0.778 CA 1.459 10 residues pruned to eliminate duplicates Z: 18 40.136 2.107 1.137 0.858 1.000 0.941 CA 1.591 18 residues pruned to eliminate duplicates Z: 216 97.556 2.249 0.870 0.573 0.940 0.614 CB 1.570 169 residues pruned to eliminate duplicates Z: 16 46.237 2.298 1.216 0.945 0.933 0.533 CB 1.739 16 residues pruned to eliminate duplicates Z: 14 19.088 1.953 0.709 0.931 1.000 0.846 CB 1.108 Z: 12 18.626 1.885 1.102 0.724 0.909 0.636 CB 1.274 12 residues pruned to eliminate duplicates Z: 50 58.713 2.227 1.050 0.720 0.980 0.735 CB 1.537 50 residues pruned to eliminate duplicates Z: 17 28.511 2.030 0.888 0.913 0.938 0.750 CA 1.404 17 residues pruned to eliminate duplicates Z: 17 43.209 2.254 1.202 0.898 0.938 0.625 CB 1.660 17 residues pruned to eliminate duplicates Z: 11 15.207 1.996 0.577 0.724 0.900 0.500 CB 1.387 11 residues pruned to eliminate duplicates Z: 11 11.374 2.024 0.386 0.777 0.800 0.700 CB 1.255 11 residues pruned to eliminate duplicates Z: 27 28.440 2.205 0.860 0.469 0.846 0.423 CB 1.658 27 residues pruned to eliminate duplicates Z: 10 17.824 1.970 0.679 0.876 0.889 0.778 CB 1.468 10 residues pruned to eliminate duplicates Z: 17 24.338 2.018 0.737 0.888 1.000 0.625 CB 1.251 17 residues pruned to eliminate duplicates Z: 20 39.182 2.219 1.174 0.824 0.895 0.474 CA 1.573 20 residues pruned to eliminate duplicates Z: 17 22.876 2.292 0.760 0.499 0.875 0.562 CB 1.621 17 residues pruned to eliminate duplicates Z: 18 41.827 2.176 0.969 0.933 1.000 0.824 CB 1.652 Z: 16 45.839 2.295 1.067 0.931 1.000 0.867 CA 1.744 16 residues pruned to eliminate duplicates Z: 10 16.180 2.053 1.116 0.741 0.778 0.667 CA 1.286 Z: 19 17.971 2.203 0.687 0.485 0.778 0.500 CB 1.488 19 residues pruned to eliminate duplicates Z: 14 30.726 2.120 0.846 0.898 0.923 0.769 CB 1.688 14 residues pruned to eliminate duplicates Z: 9 14.751 2.156 0.803 0.709 0.750 0.625 CB 1.480 9 residues pruned to eliminate duplicates Z: 56 51.660 2.244 0.784 0.653 0.964 0.727 CB 1.565 56 residues pruned to eliminate duplicates Z: 7 9.239 1.935 0.444 0.596 0.833 0.833 CA 1.479 7 residues pruned to eliminate duplicates Z: 56 68.745 2.424 1.063 0.628 0.927 0.582 CB 1.772 33 residues pruned to eliminate duplicates Z: 42 49.178 2.308 1.066 0.625 0.854 0.585 CB 1.677 Z: 9 15.453 2.224 0.346 0.776 1.000 0.750 CB 1.430 9 residues pruned to eliminate duplicates Z: 88 77.748 2.450 0.961 0.589 0.920 0.655 CB 1.732 88 residues pruned to eliminate duplicates Z: 83 65.486 2.193 0.902 0.646 0.927 0.646 CB 1.632 88 residues pruned to eliminate duplicates Z: 10 16.736 2.177 0.437 0.787 0.889 0.778 CA 1.559 10 residues pruned to eliminate duplicates Z: 13 16.151 2.007 0.236 0.864 1.000 1.000 CB 1.378 13 residues pruned to eliminate duplicates Z: 114 81.834 2.296 0.978 0.619 0.929 0.611 CB 1.630 114 residues pruned to eliminate duplicates Z: 21 18.465 2.133 0.563 0.447 0.900 0.400 CB 1.453 21 residues pruned to eliminate duplicates Z: 15 35.985 2.095 1.245 0.897 0.929 0.429 CA 1.576 15 residues pruned to eliminate duplicates Z: 9 20.239 2.093 0.913 0.643 1.000 0.750 CA 1.563 10 residues pruned to eliminate duplicates Z: 18 33.523 2.272 0.748 0.766 1.000 0.529 CA 1.616 18 residues pruned to eliminate duplicates Z: 14 32.401 2.357 0.643 0.929 1.000 0.846 CA 1.624 14 residues pruned to eliminate duplicates Z: 14 36.442 2.288 1.034 0.934 1.000 0.923 CB 1.515 14 residues pruned to eliminate duplicates Z: 16 31.649 2.126 0.864 0.925 1.000 0.800 CA 1.447 16 residues pruned to eliminate duplicates Z: 15 12.848 2.056 0.606 0.337 0.929 0.643 CB 1.338 15 residues pruned to eliminate duplicates Z: 14 46.045 2.325 1.346 0.898 1.000 0.846 CA 1.675 14 residues pruned to eliminate duplicates Z: 18 42.908 2.274 1.211 0.923 0.941 0.824 CB 1.545 18 residues pruned to eliminate duplicates Z: 33 26.514 2.127 0.748 0.473 0.938 0.625 CB 1.382 33 residues pruned to eliminate duplicates Z: 118 72.556 2.260 0.972 0.563 0.897 0.556 CB 1.577 98 residues pruned to eliminate duplicates Z: 10 22.328 2.272 0.738 0.803 1.000 0.667 CB 1.447 10 residues pruned to eliminate duplicates Z: 91 62.800 2.207 0.863 0.627 0.922 0.656 CB 1.548 91 residues pruned to eliminate duplicates Z: 100 79.654 2.331 1.047 0.633 0.899 0.586 CB 1.646 100 residues pruned to eliminate duplicates Z: 11 20.534 2.308 0.410 0.821 1.000 0.800 CA 1.511 11 residues pruned to eliminate duplicates Z: 16 23.228 2.127 0.719 0.867 0.933 0.800 CB 1.286 16 residues pruned to eliminate duplicates Z: 16 24.163 2.125 0.855 0.870 0.867 0.600 CB 1.333 16 residues pruned to eliminate duplicates Z: 10 16.793 2.261 0.170 0.819 1.000 1.000 CA 1.605 10 residues pruned to eliminate duplicates Z: 154 79.160 2.168 0.842 0.608 0.922 0.660 CB 1.570 116 residues pruned to eliminate duplicates Z: 15 37.524 2.192 1.025 0.926 1.000 0.643 CA 1.584 15 residues pruned to eliminate duplicates Z: 22 37.516 2.510 1.058 0.651 0.857 0.619 CB 1.607 22 residues pruned to eliminate duplicates Z: 14 29.999 2.130 1.089 0.858 0.923 0.615 CB 1.493 14 residues pruned to eliminate duplicates Z: 84 74.006 2.329 0.938 0.657 0.952 0.627 CB 1.634 84 residues pruned to eliminate duplicates Z: 15 34.814 2.257 0.898 0.930 1.000 0.929 CB 1.519 15 residues pruned to eliminate duplicates Z: 114 89.123 2.340 1.028 0.650 0.938 0.637 CB 1.638 120 residues pruned to eliminate duplicates Z: 13 40.173 2.303 1.071 0.902 1.000 0.833 CA 1.735 13 residues pruned to eliminate duplicates Z: 109 76.191 2.277 0.988 0.599 0.917 0.620 CB 1.609 109 residues pruned to eliminate duplicates Z: 71 69.743 2.301 0.949 0.667 0.943 0.600 CB 1.689 71 residues pruned to eliminate duplicates Z: 8 2.888 1.778 0.068 0.531 0.571 0.429 CB 0.976 Z: 17 42.540 2.276 1.094 0.930 1.000 0.625 CB 1.561 17 residues pruned to eliminate duplicates Z: 26 47.556 2.442 1.118 0.646 0.920 0.680 CB 1.745 26 residues pruned to eliminate duplicates Z: 14 37.531 2.231 1.092 0.888 1.000 0.769 CA 1.607 14 residues pruned to eliminate duplicates Z: 6 6.489 1.898 0.396 0.465 0.800 0.400 CB 1.418 6 residues pruned to eliminate duplicates Z: 9 27.538 2.327 0.785 0.924 1.000 0.750 CB 1.647 9 residues pruned to eliminate duplicates Z: 17 40.374 2.235 1.055 0.905 1.000 0.875 CA 1.565 17 residues pruned to eliminate duplicates Z: 17 44.328 2.283 1.167 0.892 0.938 0.625 CB 1.716 17 residues pruned to eliminate duplicates Z: 42 35.635 2.131 0.724 0.616 0.902 0.659 CB 1.504 42 residues pruned to eliminate duplicates Z: 14 41.532 2.389 0.820 0.872 1.000 0.538 CB 1.930 14 residues pruned to eliminate duplicates Z: 15 8.379 1.780 0.190 0.499 0.786 0.429 CB 1.347 Z: 13 37.793 2.528 1.118 0.920 0.833 0.833 CA 1.721 13 residues pruned to eliminate duplicates Z: 10 14.790 2.007 0.721 0.662 0.889 0.778 CB 1.381 Z: 96 45.255 2.131 0.710 0.421 0.905 0.453 CB 1.528 89 residues pruned to eliminate duplicates Z: 69 75.646 2.396 1.155 0.648 0.897 0.588 CB 1.725 69 residues pruned to eliminate duplicates Z: 84 69.731 2.340 0.876 0.645 0.928 0.687 CB 1.641 84 residues pruned to eliminate duplicates Z: 130 70.929 2.193 0.973 0.545 0.891 0.589 CB 1.549 118 residues pruned to eliminate duplicates Z: 21 12.064 1.732 0.762 0.326 0.850 0.550 CB 1.258 21 residues pruned to eliminate duplicates Z: 10 20.704 2.111 0.814 0.779 1.000 0.556 CA 1.409 10 residues pruned to eliminate duplicates Z: 11 13.522 2.177 0.101 0.758 1.000 0.900 CB 1.418 11 residues pruned to eliminate duplicates Z: 13 17.253 1.909 0.612 0.852 1.000 0.833 CB 1.198 13 residues pruned to eliminate duplicates Z: 53 37.904 2.085 0.747 0.593 0.942 0.615 CB 1.401 28 residues pruned to eliminate duplicates Z: 10 22.851 2.011 1.064 0.798 1.000 0.667 CA 1.414 10 residues pruned to eliminate duplicates Z: 9 18.805 2.028 0.760 0.784 0.875 0.625 CA 1.658 9 residues pruned to eliminate duplicates Z: 104 69.476 2.239 0.898 0.615 0.903 0.612 CB 1.600 104 residues pruned to eliminate duplicates Z: 80 66.756 2.267 0.972 0.623 0.937 0.608 CB 1.598 79 residues pruned to eliminate duplicates Z: 17 39.953 2.205 1.027 0.915 1.000 0.875 CA 1.579 17 residues pruned to eliminate duplicates Z: 24 24.121 2.125 0.664 0.544 0.913 0.565 CB 1.493 20 residues pruned to eliminate duplicates Z: 20 22.878 2.132 0.826 0.570 0.895 0.579 CB 1.408 26 residues pruned to eliminate duplicates Z: 9 29.966 2.350 1.163 0.913 0.875 0.250 CB 1.686 9 residues pruned to eliminate duplicates Z: 38 19.542 2.089 0.421 0.416 0.811 0.486 CB 1.457 38 residues pruned to eliminate duplicates Z: 84 69.177 2.221 0.969 0.650 0.952 0.675 CB 1.587 89 residues pruned to eliminate duplicates Z: 16 29.990 2.164 0.724 0.947 1.000 0.933 CB 1.434 16 residues pruned to eliminate duplicates Z: 39 38.013 2.143 0.722 0.651 0.974 0.605 CB 1.490 39 residues pruned to eliminate duplicates Z: 17 7.637 1.744 0.187 0.277 0.875 0.562 CA 1.356 17 residues pruned to eliminate duplicates Z: 9 26.979 2.333 0.794 0.926 1.000 0.875 CB 1.598 9 residues pruned to eliminate duplicates Z: 16 26.963 2.114 0.915 0.904 0.933 0.733 CB 1.312 16 residues pruned to eliminate duplicates Z: 8 7.390 1.573 0.587 0.595 1.000 0.429 CA 1.022 8 residues pruned to eliminate duplicates Z: 14 23.655 2.093 0.728 0.855 0.923 0.769 CB 1.451 14 residues pruned to eliminate duplicates Z: 14 17.607 1.923 0.615 0.909 1.000 0.846 CB 1.116 14 residues pruned to eliminate duplicates Z: 94 64.237 2.154 0.907 0.615 0.925 0.645 CB 1.573 94 residues pruned to eliminate duplicates Z: 145 77.122 2.153 0.887 0.599 0.931 0.618 CB 1.547 159 residues pruned to eliminate duplicates Z: 16 34.590 2.182 0.960 0.932 1.000 0.733 CA 1.458 16 residues pruned to eliminate duplicates Z: 24 35.347 2.265 1.014 0.573 0.826 0.652 CA 1.822 24 residues pruned to eliminate duplicates Z: 86 71.546 2.303 0.949 0.654 0.929 0.647 CB 1.612 86 residues pruned to eliminate duplicates Z: 19 16.843 2.101 0.733 0.452 0.889 0.556 CB 1.289 19 residues pruned to eliminate duplicates Z: 15 28.506 2.136 0.827 0.898 0.929 0.714 CA 1.503 15 residues pruned to eliminate duplicates Z: 16 25.510 2.034 0.470 0.926 1.000 1.000 CA 1.545 16 residues pruned to eliminate duplicates Z: 38 24.131 2.079 0.625 0.486 0.865 0.568 CB 1.377 38 residues pruned to eliminate duplicates Z: 9 15.486 2.044 0.455 0.826 0.875 0.750 CB 1.586 9 residues pruned to eliminate duplicates Z: 21 25.035 2.172 0.883 0.481 0.950 0.600 CB 1.469 21 residues pruned to eliminate duplicates Z: 10 12.527 1.892 0.429 0.779 1.000 0.556 CA 1.207 10 residues pruned to eliminate duplicates Z: 10 10.982 2.125 0.046 0.861 0.889 0.889 CB 1.361 10 residues pruned to eliminate duplicates Z: 14 40.722 2.323 0.867 0.916 1.000 0.538 CB 1.840 14 residues pruned to eliminate duplicates Z: 12 19.064 1.943 0.800 0.915 0.818 0.636 CB 1.419 12 residues pruned to eliminate duplicates Z: 90 67.993 2.205 0.898 0.664 0.933 0.674 CB 1.587 83 residues pruned to eliminate duplicates Z: 18 31.790 2.279 1.048 0.577 0.941 0.706 CB 1.630 18 residues pruned to eliminate duplicates Z: 57 43.391 2.190 0.860 0.565 0.911 0.625 CB 1.468 57 residues pruned to eliminate duplicates Z: 14 28.153 2.212 0.833 0.925 0.923 0.769 CB 1.463 14 residues pruned to eliminate duplicates Z: 7 11.763 2.018 0.678 0.686 0.833 0.833 CB 1.435 7 residues pruned to eliminate duplicates Z: 15 13.501 1.825 0.427 0.532 0.929 0.571 CA 1.447 15 residues pruned to eliminate duplicates Z: 16 22.023 1.690 0.833 0.919 1.000 0.800 CB 1.294 16 residues pruned to eliminate duplicates Z: 9 19.803 2.260 0.609 0.856 0.875 0.875 CB 1.623 9 residues pruned to eliminate duplicates Z: 9 13.612 2.083 0.965 0.676 0.750 0.750 CB 1.333 8 residues pruned to eliminate duplicates Z: 17 25.988 1.891 0.784 0.917 0.938 0.812 CB 1.449 17 residues pruned to eliminate duplicates Z: 16 27.595 2.037 0.675 0.920 0.933 0.800 CB 1.576 16 residues pruned to eliminate duplicates Z: 122 79.030 2.369 0.801 0.595 0.893 0.669 CB 1.723 122 residues pruned to eliminate duplicates Z: 12 35.793 2.384 1.057 0.926 0.909 0.818 CB 1.698 12 residues pruned to eliminate duplicates Z: 12 16.023 1.895 1.007 0.772 0.727 0.455 CB 1.373 12 residues pruned to eliminate duplicates Z: 43 39.158 2.224 0.598 0.681 0.929 0.714 CB 1.551 43 residues pruned to eliminate duplicates Z: 16 28.851 2.109 0.751 0.903 1.000 0.733 CB 1.437 16 residues pruned to eliminate duplicates Z: 13 26.749 2.282 0.645 0.932 0.917 0.833 CA 1.567 13 residues pruned to eliminate duplicates Z: 158 94.374 2.301 0.994 0.590 0.943 0.592 CB 1.598 158 residues pruned to eliminate duplicates Z: 124 90.878 2.376 0.995 0.604 0.927 0.650 CB 1.690 124 residues pruned to eliminate duplicates Z: 14 14.789 1.872 0.700 0.791 0.846 0.538 CB 1.181 14 residues pruned to eliminate duplicates Z: 14 32.816 2.105 0.868 0.866 1.000 0.846 CA 1.694 14 residues pruned to eliminate duplicates Z: 14 28.542 2.135 0.751 0.899 0.923 0.385 CB 1.640 14 residues pruned to eliminate duplicates Z: 16 44.254 2.316 1.104 0.936 1.000 1.000 CA 1.633 16 residues pruned to eliminate duplicates Z: 15 27.419 2.072 0.886 0.908 0.929 0.786 CA 1.434 15 residues pruned to eliminate duplicates Z: 17 37.978 2.189 1.036 0.912 0.938 0.500 CA 1.609 17 residues pruned to eliminate duplicates Z: 24 21.470 2.002 0.607 0.596 0.870 0.565 CB 1.460 25 residues pruned to eliminate duplicates Z: 16 25.377 2.058 0.534 0.901 0.933 0.800 CA 1.588 16 residues pruned to eliminate duplicates Z: 13 22.221 2.077 0.610 0.847 0.917 0.750 CA 1.554 13 residues pruned to eliminate duplicates Z: 10 17.763 2.187 0.304 0.914 1.000 1.000 CB 1.468 10 residues pruned to eliminate duplicates Z: 10 9.595 1.992 0.373 0.351 0.889 0.667 CA 1.547 Z: 10 16.955 1.913 0.443 0.921 1.000 0.889 CB 1.440 10 residues pruned to eliminate duplicates Z: 45 43.686 2.140 0.899 0.693 0.886 0.591 CB 1.532 45 residues pruned to eliminate duplicates Z: 11 17.226 1.903 0.888 0.768 0.900 0.400 CB 1.328 11 residues pruned to eliminate duplicates Z: 16 43.434 2.321 1.057 0.919 1.000 0.933 CA 1.655 16 residues pruned to eliminate duplicates Z: 16 29.688 2.194 0.806 0.922 0.933 0.800 CA 1.457 16 residues pruned to eliminate duplicates Z: 67 64.316 2.444 0.986 0.583 0.879 0.561 CB 1.715 67 residues pruned to eliminate duplicates Z: 12 13.755 1.919 0.441 0.761 0.909 0.636 CB 1.309 12 residues pruned to eliminate duplicates Z: 14 36.310 2.254 0.966 0.878 1.000 0.923 CA 1.649 14 residues pruned to eliminate duplicates Z: 15 37.583 2.165 1.079 0.936 1.000 0.571 CA 1.554 15 residues pruned to eliminate duplicates Z: 16 45.658 2.322 1.078 0.922 1.000 0.800 CB 1.718 16 residues pruned to eliminate duplicates Z: 11 21.622 2.041 0.685 0.819 1.000 0.600 CB 1.508 11 residues pruned to eliminate duplicates Z: 140 76.143 2.163 0.935 0.588 0.921 0.633 CB 1.540 142 residues pruned to eliminate duplicates Z: 12 10.557 2.319 0.371 0.557 0.636 0.455 CA 1.488 12 residues pruned to eliminate duplicates Z: 52 23.899 1.910 0.528 0.491 0.843 0.608 CB 1.372 52 residues pruned to eliminate duplicates Z: 15 7.371 1.705 0.685 0.257 0.786 0.214 CB 1.153 15 residues pruned to eliminate duplicates Z: 16 40.231 2.300 0.943 0.901 1.000 0.733 CB 1.660 16 residues pruned to eliminate duplicates Z: 151 81.544 2.173 0.851 0.612 0.947 0.647 CB 1.572 151 residues pruned to eliminate duplicates Z: 9 27.432 2.351 0.695 0.916 1.000 1.000 CB 1.719 9 residues pruned to eliminate duplicates Z: 16 31.579 2.140 0.742 0.920 1.000 0.867 CA 1.541 16 residues pruned to eliminate duplicates Z: 34 23.882 2.213 0.592 0.494 0.818 0.545 CB 1.451 34 residues pruned to eliminate duplicates Z: 29 17.748 1.856 0.513 0.560 0.857 0.643 CB 1.315 29 residues pruned to eliminate duplicates Z: 56 39.505 2.130 0.780 0.553 0.909 0.727 CB 1.468 56 residues pruned to eliminate duplicates Z: 11 19.952 2.133 0.403 0.925 1.000 1.000 CB 1.480 11 residues pruned to eliminate duplicates Z: 13 9.247 2.084 0.689 0.410 0.583 0.583 CB 1.429 13 residues pruned to eliminate duplicates Z: 16 25.299 2.019 0.499 0.925 1.000 0.933 CB 1.515 16 residues pruned to eliminate duplicates Z: 102 73.412 2.313 0.954 0.591 0.911 0.574 CB 1.626 102 residues pruned to eliminate duplicates Z: 6 17.215 2.204 0.928 0.629 1.000 1.000 CA 1.605 7 residues pruned to eliminate duplicates Z: 12 24.834 2.060 0.604 0.945 1.000 0.909 CB 1.569 12 residues pruned to eliminate duplicates Z: 11 20.894 2.200 0.793 0.761 0.800 0.800 CA 1.661 11 residues pruned to eliminate duplicates Z: 15 29.142 2.121 0.738 0.902 1.000 0.643 CB 1.507 15 residues pruned to eliminate duplicates Z: 15 52.026 2.401 1.311 0.943 1.000 0.714 CB 1.737 15 residues pruned to eliminate duplicates Z: 17 27.957 2.041 0.901 0.907 0.875 0.625 CA 1.463 17 residues pruned to eliminate duplicates Z: 12 16.816 1.960 0.289 0.931 1.000 1.000 CA 1.402 12 residues pruned to eliminate duplicates Z: 17 15.796 1.845 0.465 0.784 0.875 0.438 CB 1.300 17 residues pruned to eliminate duplicates Z: 18 33.899 2.137 1.077 0.814 0.941 0.706 CB 1.498 18 residues pruned to eliminate duplicates Z: 16 54.976 2.363 1.469 0.939 1.000 0.667 CB 1.691 16 residues pruned to eliminate duplicates Z: 9 21.714 2.238 0.598 0.841 1.000 0.625 CB 1.601 9 residues pruned to eliminate duplicates Z: 15 30.862 2.222 0.933 0.814 0.929 0.786 CA 1.574 15 residues pruned to eliminate duplicates Z: 73 37.825 2.094 0.710 0.497 0.833 0.556 CB 1.498 73 residues pruned to eliminate duplicates Z: 14 24.585 2.247 0.773 0.929 0.923 0.846 CB 1.297 14 residues pruned to eliminate duplicates Z: 9 23.439 2.229 0.863 0.889 1.000 0.500 CB 1.436 9 residues pruned to eliminate duplicates Z: 70 37.232 2.124 0.743 0.451 0.855 0.565 CB 1.489 70 residues pruned to eliminate duplicates Z: 17 35.289 2.212 0.864 0.911 1.000 0.688 CB 1.517 17 residues pruned to eliminate duplicates Z: 12 54.491 2.564 1.298 0.920 1.000 0.727 CB 1.963 12 residues pruned to eliminate duplicates Z: 16 30.354 2.176 0.783 0.908 1.000 0.800 CA 1.435 16 residues pruned to eliminate duplicates Z: 18 10.500 1.939 0.566 0.311 0.765 0.412 CB 1.352 18 residues pruned to eliminate duplicates Z: 17 27.463 2.033 0.889 0.910 0.938 0.688 CB 1.353 17 residues pruned to eliminate duplicates Z: 6 10.220 2.235 0.265 0.607 1.000 0.600 CB 1.460 6 residues pruned to eliminate duplicates Z: 87 66.559 2.230 0.860 0.629 0.942 0.698 CB 1.627 87 residues pruned to eliminate duplicates Z: 82 66.503 2.262 0.928 0.664 0.914 0.654 CB 1.594 82 residues pruned to eliminate duplicates Z: 102 83.757 2.324 1.045 0.609 0.941 0.634 CB 1.681 128 residues pruned to eliminate duplicates Z: 15 30.870 2.159 1.073 0.897 0.857 0.786 CB 1.538 15 residues pruned to eliminate duplicates Z: 82 73.430 2.333 0.986 0.641 0.938 0.654 CB 1.645 82 residues pruned to eliminate duplicates Z: 15 31.580 2.131 0.899 0.906 1.000 0.714 CA 1.483 15 residues pruned to eliminate duplicates Z: 92 61.034 2.166 0.892 0.603 0.923 0.626 CB 1.534 92 residues pruned to eliminate duplicates Z: 145 81.993 2.398 0.891 0.531 0.889 0.604 CB 1.643 145 residues pruned to eliminate duplicates Z: 9 18.641 2.040 0.856 0.792 0.875 0.500 CA 1.539 9 residues pruned to eliminate duplicates Z: 6 2.412 1.610 -0.081 0.305 0.800 0.400 CB 1.131 Z: 75 66.516 2.231 0.981 0.673 0.919 0.716 CB 1.623 75 residues pruned to eliminate duplicates Z: 17 43.539 2.266 1.100 0.923 1.000 0.562 CB 1.608 17 residues pruned to eliminate duplicates Z: 12 31.535 2.263 1.045 0.907 0.909 0.818 CB 1.607 12 residues pruned to eliminate duplicates Z: 16 25.103 2.105 1.043 0.866 0.933 0.733 CB 1.182 16 residues pruned to eliminate duplicates Z: 71 73.388 2.354 1.111 0.653 0.929 0.629 CB 1.648 71 residues pruned to eliminate duplicates Z: 15 26.228 2.247 0.725 0.934 1.000 0.929 CB 1.261 15 residues pruned to eliminate duplicates Z: 13 23.597 1.967 0.783 0.918 1.000 0.667 CA 1.370 13 residues pruned to eliminate duplicates Z: 63 63.168 2.314 1.000 0.575 0.952 0.581 CB 1.695 63 residues pruned to eliminate duplicates Z: 29 23.940 2.084 0.725 0.358 0.929 0.500 CB 1.579 29 residues pruned to eliminate duplicates Z: 10 12.601 2.242 0.547 0.381 0.889 0.556 CB 1.547 10 residues pruned to eliminate duplicates Z: 9 16.765 2.049 0.544 0.897 1.000 1.000 CB 1.341 9 residues pruned to eliminate duplicates Z: 14 13.772 1.828 0.597 0.901 1.000 0.923 CB 0.934 14 residues pruned to eliminate duplicates Z: 8 17.703 2.167 1.019 0.756 0.857 0.714 CB 1.420 8 residues pruned to eliminate duplicates Z: 16 11.063 1.689 0.169 0.894 1.000 0.933 CB 1.038 16 residues pruned to eliminate duplicates Z: 83 73.818 2.267 1.020 0.659 0.963 0.646 CB 1.595 83 residues pruned to eliminate duplicates Z: 13 26.159 2.214 0.617 0.806 0.917 0.583 CB 1.762 13 residues pruned to eliminate duplicates Z: 34 35.181 2.129 0.928 0.585 0.909 0.545 CB 1.512 34 residues pruned to eliminate duplicates Z: 15 29.966 2.268 0.755 0.929 1.000 0.929 CB 1.408 15 residues pruned to eliminate duplicates Z: 10 19.007 1.947 0.646 0.887 1.000 0.667 CB 1.426 10 residues pruned to eliminate duplicates Z: 93 81.016 2.372 1.029 0.642 0.902 0.641 CB 1.703 93 residues pruned to eliminate duplicates Z: 9 25.229 2.263 0.834 0.897 1.000 0.625 CB 1.539 9 residues pruned to eliminate duplicates Z: 17 30.114 2.038 0.991 0.910 0.938 0.812 CA 1.404 17 residues pruned to eliminate duplicates Z: 41 49.693 2.296 1.044 0.627 0.875 0.600 CB 1.698 41 residues pruned to eliminate duplicates Z: 11 22.258 2.041 0.924 0.823 1.000 0.800 CB 1.355 11 residues pruned to eliminate duplicates Z: 15 32.090 2.104 1.106 0.886 0.929 0.786 CB 1.504 15 residues pruned to eliminate duplicates Z: 21 24.872 2.082 0.828 0.523 0.900 0.500 CA 1.587 21 residues pruned to eliminate duplicates Z: 8 13.040 1.823 0.644 0.907 1.000 0.857 CB 1.169 Z: 67 59.888 2.288 0.888 0.652 0.924 0.621 CB 1.603 67 residues pruned to eliminate duplicates Z: 17 42.346 2.256 1.200 0.923 1.000 0.688 CB 1.498 17 residues pruned to eliminate duplicates Z: 15 26.956 2.289 0.831 0.824 0.857 0.857 CA 1.515 15 residues pruned to eliminate duplicates Z: 6 7.031 1.894 0.539 0.618 0.800 0.800 CA 1.206 6 residues pruned to eliminate duplicates Z: 10 12.505 1.767 0.758 0.759 0.889 0.444 CA 1.199 10 residues pruned to eliminate duplicates Z: 13 29.797 2.205 0.836 0.913 1.000 0.750 CA 1.503 13 residues pruned to eliminate duplicates Z: 90 67.365 2.161 0.944 0.625 0.944 0.618 CB 1.601 90 residues pruned to eliminate duplicates Z: 25 14.475 1.887 0.724 0.389 0.792 0.458 CB 1.291 16 residues pruned to eliminate duplicates Z: 26 17.633 2.162 0.584 0.353 0.800 0.520 CA 1.508 26 residues pruned to eliminate duplicates Z: 15 26.892 2.078 0.823 0.861 1.000 0.786 CB 1.394 15 residues pruned to eliminate duplicates Z: 71 63.020 2.213 0.883 0.699 0.943 0.643 CB 1.598 71 residues pruned to eliminate duplicates Z: 18 45.381 2.311 1.194 0.938 0.941 0.824 CB 1.604 18 residues pruned to eliminate duplicates Z: 15 21.328 2.047 0.355 0.913 0.929 0.929 CB 1.567 15 residues pruned to eliminate duplicates Z: 26 37.071 2.236 1.059 0.622 0.880 0.760 CB 1.631 26 residues pruned to eliminate duplicates Z: 36 37.550 2.176 0.941 0.602 0.914 0.571 CB 1.491 36 residues pruned to eliminate duplicates Z: 88 63.847 2.194 0.851 0.649 0.931 0.609 CB 1.577 88 residues pruned to eliminate duplicates Z: 91 52.386 2.162 0.736 0.612 0.867 0.578 CB 1.526 91 residues pruned to eliminate duplicates Z: 10 15.270 1.964 0.584 0.828 0.889 0.778 CB 1.386 10 residues pruned to eliminate duplicates Z: 82 72.811 2.323 1.035 0.633 0.926 0.642 CB 1.631 82 residues pruned to eliminate duplicates Z: 10 20.149 2.242 0.416 0.880 1.000 1.000 CB 1.532 10 residues pruned to eliminate duplicates Z: 7 6.527 1.770 0.276 0.572 1.000 0.333 CB 1.100 7 residues pruned to eliminate duplicates Z: 14 40.732 2.344 0.991 0.861 1.000 0.846 CA 1.779 14 residues pruned to eliminate duplicates Z: 16 41.148 2.363 1.463 0.907 0.933 0.667 CB 1.391 16 residues pruned to eliminate duplicates Z: 12 12.106 1.984 0.070 0.844 0.909 0.818 CA 1.408 12 residues pruned to eliminate duplicates Z: 15 15.577 1.735 0.280 0.926 1.000 0.929 CB 1.315 15 residues pruned to eliminate duplicates Z: 7 2.224 1.769 0.149 0.228 0.500 0.333 CB 1.228 7 residues pruned to eliminate duplicates Z: 12 37.836 2.228 1.454 0.891 0.909 0.455 CA 1.649 12 residues pruned to eliminate duplicates Z: 9 11.703 2.092 0.805 0.409 0.875 0.250 CA 1.378 9 residues pruned to eliminate duplicates Z: 8 17.683 2.070 0.695 0.865 1.000 0.857 CB 1.396 8 residues pruned to eliminate duplicates Z: 14 39.640 2.131 1.251 0.884 1.000 0.692 CB 1.655 14 residues pruned to eliminate duplicates Z: 11 13.692 2.017 0.739 0.443 0.800 0.500 CA 1.635 11 residues pruned to eliminate duplicates Z: 14 14.300 1.888 0.430 0.903 1.000 0.923 CB 1.047 14 residues pruned to eliminate duplicates Z: 7 12.794 2.172 0.473 0.863 0.833 0.667 CB 1.438 7 residues pruned to eliminate duplicates Z: 114 81.060 2.242 0.955 0.639 0.938 0.575 CB 1.629 114 residues pruned to eliminate duplicates Z: 13 16.932 1.949 0.626 0.917 1.000 0.833 CB 1.089 13 residues pruned to eliminate duplicates Z: 56 46.388 2.315 0.741 0.541 0.891 0.618 CB 1.673 56 residues pruned to eliminate duplicates Z: 13 10.985 1.991 0.683 0.393 0.750 0.583 CB 1.414 13 residues pruned to eliminate duplicates Z: 16 32.836 2.058 0.923 0.902 1.000 0.867 CA 1.528 16 residues pruned to eliminate duplicates Z: 74 45.337 2.148 0.830 0.484 0.904 0.616 CB 1.518 74 residues pruned to eliminate duplicates Z: 7 5.946 1.757 -0.011 0.756 1.000 1.000 CA 1.112 7 residues pruned to eliminate duplicates Z: 10 9.966 1.737 0.257 0.876 1.000 0.889 CB 1.106 10 residues pruned to eliminate duplicates Z: 15 24.846 2.124 0.684 0.859 0.929 0.714 CA 1.471 15 residues pruned to eliminate duplicates Z: 11 13.867 1.848 0.302 0.814 1.000 0.700 CA 1.387 11 residues pruned to eliminate duplicates Z: 17 29.078 2.049 0.952 0.853 0.938 0.750 CB 1.433 17 residues pruned to eliminate duplicates Z: 138 93.384 2.315 1.007 0.620 0.942 0.606 CB 1.628 138 residues pruned to eliminate duplicates Z: 41 47.576 2.359 0.939 0.544 0.925 0.650 CB 1.704 41 residues pruned to eliminate duplicates Z: 16 36.553 2.136 1.106 0.913 1.000 0.800 CA 1.485 16 residues pruned to eliminate duplicates Z: 17 23.933 2.015 0.700 0.903 0.938 0.875 CA 1.329 17 residues pruned to eliminate duplicates Z: 25 19.989 2.065 0.715 0.504 0.875 0.708 CB 1.311 25 residues pruned to eliminate duplicates Z: 10 12.237 1.866 0.578 0.822 1.000 0.556 CB 1.048 10 residues pruned to eliminate duplicates Z: 108 84.013 2.316 1.020 0.646 0.925 0.645 CB 1.638 108 residues pruned to eliminate duplicates Z: 14 22.515 2.258 0.747 0.909 0.846 0.769 CB 1.327 14 residues pruned to eliminate duplicates Z: 27 34.686 2.322 0.837 0.541 0.962 0.500 CB 1.593 27 residues pruned to eliminate duplicates Z: 16 19.353 2.256 0.578 0.454 0.867 0.733 CB 1.697 16 residues pruned to eliminate duplicates Z: 89 71.715 2.262 0.999 0.626 0.943 0.534 CB 1.592 89 residues pruned to eliminate duplicates Z: 10 13.878 2.097 0.677 0.659 0.778 0.778 CB 1.459 9 residues pruned to eliminate duplicates Z: 60 55.047 2.322 1.024 0.572 0.864 0.610 CB 1.646 60 residues pruned to eliminate duplicates Z: 8 8.642 1.722 0.628 0.533 1.000 0.571 CB 1.128 Z: 11 16.323 2.052 0.667 0.861 1.000 0.600 CB 1.108 11 residues pruned to eliminate duplicates Z: 18 31.571 2.150 0.818 0.849 0.941 0.529 CB 1.543 18 residues pruned to eliminate duplicates Z: 87 66.366 2.223 0.837 0.644 0.942 0.593 CB 1.625 87 residues pruned to eliminate duplicates Z: 121 61.101 2.094 0.732 0.583 0.925 0.633 CB 1.535 121 residues pruned to eliminate duplicates Z: 12 14.087 2.064 0.378 0.725 0.909 0.545 CB 1.341 12 residues pruned to eliminate duplicates Z: 19 13.021 1.785 0.521 0.520 0.778 0.500 N 1.424 18 residues pruned to eliminate duplicates Z: 14 26.206 2.116 0.794 0.774 0.923 0.769 CA 1.628 14 residues pruned to eliminate duplicates Z: 11 12.349 1.611 0.731 0.772 1.000 0.700 CB 1.101 11 residues pruned to eliminate duplicates Z: 14 16.443 1.981 0.650 0.658 0.846 0.615 CB 1.423 14 residues pruned to eliminate duplicates Z: 13 7.820 1.872 0.372 0.429 0.833 0.500 CB 1.135 13 residues pruned to eliminate duplicates Z: 70 48.858 2.277 0.853 0.492 0.913 0.594 CB 1.539 70 residues pruned to eliminate duplicates Z: 11 22.675 1.915 0.999 0.787 1.000 0.700 CB 1.455 11 residues pruned to eliminate duplicates Z: 85 77.172 2.346 1.014 0.643 0.952 0.643 CB 1.638 85 residues pruned to eliminate duplicates Z: 12 5.881 1.561 0.577 0.388 0.818 0.455 CB 0.991 11 residues pruned to eliminate duplicates Z: 9 27.201 2.342 0.750 0.913 1.000 0.875 CB 1.660 9 residues pruned to eliminate duplicates Z: 10 13.007 1.893 0.509 0.780 0.889 0.778 CA 1.335 10 residues pruned to eliminate duplicates Z: 33 51.102 2.320 1.126 0.606 0.938 0.625 CB 1.767 33 residues pruned to eliminate duplicates Z: 9 18.530 2.167 0.800 0.711 1.000 0.750 CA 1.387 9 residues pruned to eliminate duplicates Z: 47 31.323 2.105 0.706 0.495 0.891 0.696 CB 1.450 47 residues pruned to eliminate duplicates Z: 12 30.901 2.314 0.737 0.865 1.000 0.818 CB 1.697 12 residues pruned to eliminate duplicates Z: 145 91.695 2.316 0.923 0.623 0.944 0.604 CB 1.618 145 residues pruned to eliminate duplicates Z: 10 21.980 2.295 0.332 0.914 1.000 1.000 CB 1.695 10 residues pruned to eliminate duplicates Z: 8 12.335 2.004 0.564 0.629 0.857 0.714 CB 1.537 8 residues pruned to eliminate duplicates Z: 86 68.035 2.234 0.962 0.663 0.941 0.682 CB 1.538 87 residues pruned to eliminate duplicates Z: 15 40.493 2.249 1.168 0.936 1.000 1.000 CA 1.545 15 residues pruned to eliminate duplicates Z: 10 12.829 1.899 0.536 0.838 0.889 0.667 CB 1.232 10 residues pruned to eliminate duplicates Z: 15 19.362 1.776 0.615 0.916 1.000 0.714 CA 1.274 15 residues pruned to eliminate duplicates Z: 90 72.721 2.271 0.994 0.639 0.933 0.573 CB 1.603 90 residues pruned to eliminate duplicates Z: 13 12.173 2.111 0.353 0.513 0.750 0.500 CB 1.620 13 residues pruned to eliminate duplicates Z: 7 3.108 1.726 0.619 0.246 0.500 0.333 CB 1.217 7 residues pruned to eliminate duplicates Z: 198 107.761 2.376 0.905 0.591 0.929 0.624 CB 1.673 198 residues pruned to eliminate duplicates Z: 59 50.164 2.302 0.903 0.480 0.948 0.586 CB 1.618 59 residues pruned to eliminate duplicates Z: 9 8.629 1.750 0.419 0.505 0.875 0.500 CB 1.397 Z: 17 25.125 2.032 0.743 0.864 0.938 0.812 CA 1.387 17 residues pruned to eliminate duplicates Z: 16 35.234 2.097 1.190 0.914 1.000 0.667 CA 1.401 16 residues pruned to eliminate duplicates Z: 11 11.156 1.790 0.880 0.789 0.900 0.600 CB 0.904 11 residues pruned to eliminate duplicates Z: 11 11.963 2.024 0.612 0.511 0.800 0.500 CA 1.434 11 residues pruned to eliminate duplicates Z: 67 54.197 2.225 0.971 0.607 0.894 0.606 CB 1.537 67 residues pruned to eliminate duplicates Z: 85 74.961 2.284 1.035 0.645 0.952 0.607 CB 1.613 85 residues pruned to eliminate duplicates Z: 15 32.236 2.407 1.060 0.825 0.857 0.571 CB 1.530 15 residues pruned to eliminate duplicates Z: 16 26.685 2.026 0.878 0.881 1.000 0.733 CA 1.311 16 residues pruned to eliminate duplicates Z: 6 3.628 1.676 0.024 0.515 1.000 0.800 CB 0.931 Z: 9 15.083 1.714 0.893 0.810 1.000 0.625 CA 1.255 9 residues pruned to eliminate duplicates Z: 16 18.873 2.104 0.875 0.570 0.867 0.533 CB 1.331 16 residues pruned to eliminate duplicates Z: 60 52.777 2.445 0.840 0.553 0.881 0.627 CB 1.646 60 residues pruned to eliminate duplicates Z: 15 27.143 2.140 0.656 0.925 1.000 0.857 CA 1.436 15 residues pruned to eliminate duplicates Z: 10 11.336 1.790 0.383 0.897 1.000 1.000 CB 1.092 8 residues pruned to eliminate duplicates Z: 113 77.920 2.419 0.866 0.525 0.911 0.625 CB 1.747 113 residues pruned to eliminate duplicates Z: 18 26.859 2.211 0.815 0.574 0.941 0.765 CB 1.606 18 residues pruned to eliminate duplicates Z: 102 84.139 2.331 0.983 0.657 0.941 0.653 CB 1.664 102 residues pruned to eliminate duplicates Z: 7 6.947 1.502 0.554 0.770 1.000 0.833 CB 0.957 7 residues pruned to eliminate duplicates Z: 27 30.638 2.289 0.833 0.537 0.885 0.577 CB 1.561 27 residues pruned to eliminate duplicates Z: 12 16.915 1.965 0.797 0.672 0.818 0.636 CB 1.506 12 residues pruned to eliminate duplicates Z: 7 9.013 1.853 0.657 0.674 0.833 0.667 CA 1.225 Z: 19 19.747 2.092 0.934 0.521 0.833 0.667 CB 1.352 19 residues pruned to eliminate duplicates Z: 15 18.599 2.159 0.534 0.497 0.929 0.357 CB 1.621 20 residues pruned to eliminate duplicates Z: 39 49.207 2.307 1.055 0.642 0.868 0.737 CB 1.698 39 residues pruned to eliminate duplicates Z: 17 17.710 1.833 0.544 0.794 0.875 0.375 CA 1.382 17 residues pruned to eliminate duplicates Z: 90 63.817 2.194 0.856 0.628 0.921 0.596 CB 1.599 90 residues pruned to eliminate duplicates Z: 68 56.095 2.170 1.029 0.626 0.925 0.627 CB 1.494 68 residues pruned to eliminate duplicates Z: 66 53.169 2.272 0.986 0.536 0.908 0.646 CB 1.554 66 residues pruned to eliminate duplicates Z: 15 35.227 2.139 1.009 0.906 1.000 0.857 CB 1.558 15 residues pruned to eliminate duplicates Z: 99 71.971 2.226 0.998 0.626 0.898 0.622 CB 1.616 99 residues pruned to eliminate duplicates Z: 57 60.261 2.363 0.947 0.609 0.964 0.661 CB 1.636 57 residues pruned to eliminate duplicates Z: 89 73.993 2.320 0.988 0.655 0.932 0.625 CB 1.588 89 residues pruned to eliminate duplicates Z: 10 11.944 1.720 0.613 0.797 0.889 0.778 CA 1.246 10 residues pruned to eliminate duplicates Z: 153 71.019 2.147 0.799 0.574 0.901 0.625 CB 1.541 153 residues pruned to eliminate duplicates Z: 9 8.271 1.946 0.774 0.613 0.750 0.625 CB 1.015 9 residues pruned to eliminate duplicates Z: 15 28.148 2.162 0.596 0.937 1.000 0.857 CA 1.518 15 residues pruned to eliminate duplicates Z: 11 16.475 1.899 0.654 0.886 0.900 0.600 CB 1.330 11 residues pruned to eliminate duplicates Z: 36 41.900 2.232 1.040 0.613 0.886 0.714 CB 1.578 36 residues pruned to eliminate duplicates Z: 10 16.548 1.907 0.860 0.806 1.000 0.444 CB 1.191 10 residues pruned to eliminate duplicates Z: 9 18.780 2.062 0.382 0.894 1.000 1.000 CA 1.672 9 residues pruned to eliminate duplicates Z: 27 48.331 2.397 1.168 0.602 0.923 0.654 CB 1.793 27 residues pruned to eliminate duplicates Z: 65 63.315 2.429 0.829 0.599 0.938 0.672 CB 1.729 65 residues pruned to eliminate duplicates Z: 61 63.662 2.439 0.944 0.578 0.950 0.583 CB 1.693 61 residues pruned to eliminate duplicates Z: 9 7.632 1.562 0.279 0.859 1.000 0.875 CB 0.993 Z: 144 82.611 2.188 0.907 0.621 0.944 0.664 CB 1.564 144 residues pruned to eliminate duplicates Z: 16 10.543 1.707 0.246 0.553 0.867 0.600 CA 1.402 Z: 89 68.332 2.214 0.972 0.622 0.955 0.602 CB 1.558 88 residues pruned to eliminate duplicates Z: 19 16.703 1.854 0.780 0.452 0.833 0.667 CB 1.503 19 residues pruned to eliminate duplicates Z: 15 24.118 2.002 0.735 0.891 0.929 0.571 CB 1.437 15 residues pruned to eliminate duplicates Z: 141 84.666 2.200 0.915 0.624 0.950 0.650 CB 1.590 141 residues pruned to eliminate duplicates Z: 16 35.109 2.066 1.020 0.929 1.000 0.600 CB 1.521 16 residues pruned to eliminate duplicates Z: 15 17.938 1.784 0.499 0.899 1.000 0.857 CB 1.281 15 residues pruned to eliminate duplicates Z: 147 100.870 2.338 1.042 0.621 0.959 0.651 CB 1.627 147 residues pruned to eliminate duplicates Z: 95 88.323 2.377 1.089 0.638 0.947 0.574 CB 1.703 113 residues pruned to eliminate duplicates Z: 7 7.206 1.889 -0.223 0.795 1.000 0.833 CB 1.547 Z: 6 3.918 1.470 0.270 0.571 1.000 0.800 N 0.876 Z: 14 17.910 1.964 0.543 0.930 1.000 0.923 CB 1.146 14 residues pruned to eliminate duplicates Z: 36 32.833 2.249 0.779 0.561 0.857 0.629 CB 1.525 36 residues pruned to eliminate duplicates Z: 68 46.103 2.114 0.788 0.606 0.940 0.716 CB 1.434 68 residues pruned to eliminate duplicates Z: 10 10.841 1.776 0.499 0.889 1.000 0.667 CB 0.977 10 residues pruned to eliminate duplicates Z: 15 17.724 1.801 0.753 0.861 0.929 0.500 CB 1.187 15 residues pruned to eliminate duplicates Z: 8 9.219 1.761 0.626 0.594 0.857 0.857 CB 1.297 8 residues pruned to eliminate duplicates Z: 49 42.181 2.356 0.831 0.433 0.896 0.562 CB 1.688 49 residues pruned to eliminate duplicates Z: 13 13.398 1.959 0.057 0.822 0.917 0.667 CA 1.542 13 residues pruned to eliminate duplicates Z: 18 23.815 1.971 0.675 0.855 0.941 0.765 CA 1.372 18 residues pruned to eliminate duplicates Z: 11 13.827 1.637 0.817 0.794 1.000 0.700 CB 1.136 11 residues pruned to eliminate duplicates Z: 15 26.335 2.058 0.728 0.900 0.929 0.643 CB 1.522 15 residues pruned to eliminate duplicates Z: 15 23.020 2.131 0.497 0.913 1.000 0.857 CB 1.365 15 residues pruned to eliminate duplicates Z: 9 13.570 2.035 0.538 0.821 1.000 0.875 CB 1.161 9 residues pruned to eliminate duplicates Z: 13 26.433 2.132 1.020 0.901 0.917 0.667 CB 1.379 13 residues pruned to eliminate duplicates Z: 9 8.238 1.780 0.135 0.875 0.875 0.875 CB 1.199 9 residues pruned to eliminate duplicates Z: 11 13.613 2.090 0.615 0.883 0.900 0.500 CB 1.024 11 residues pruned to eliminate duplicates Z: 65 54.068 2.209 0.847 0.642 0.922 0.594 CB 1.573 65 residues pruned to eliminate duplicates Z: 57 58.824 2.309 0.958 0.643 0.929 0.661 CB 1.638 57 residues pruned to eliminate duplicates Z: 71 65.512 2.305 1.010 0.665 0.871 0.643 CB 1.665 71 residues pruned to eliminate duplicates Z: 41 52.937 2.269 1.051 0.614 0.950 0.700 CB 1.700 41 residues pruned to eliminate duplicates Z: 70 54.798 2.179 0.913 0.658 0.928 0.681 CB 1.473 70 residues pruned to eliminate duplicates Z: 6 5.079 1.823 0.788 0.491 0.800 0.800 CB 0.879 6 residues pruned to eliminate duplicates Z: 14 16.725 1.868 0.334 0.901 1.000 0.846 CA 1.329 14 residues pruned to eliminate duplicates Z: 8 10.589 2.139 0.470 0.460 0.857 0.571 CB 1.546 8 residues pruned to eliminate duplicates Z: 6 10.109 2.088 0.223 0.767 1.000 0.600 CA 1.398 6 residues pruned to eliminate duplicates Z: 14 19.720 1.911 0.790 0.941 1.000 0.923 CB 1.109 14 residues pruned to eliminate duplicates Z: 10 13.617 1.916 0.516 0.811 0.889 0.667 CA 1.340 10 residues pruned to eliminate duplicates Z: 14 10.883 1.909 0.526 0.507 0.769 0.692 CB 1.337 14 residues pruned to eliminate duplicates Z: 15 35.877 2.394 0.889 0.922 0.929 0.786 CB 1.605 15 residues pruned to eliminate duplicates Z: 14 28.230 1.977 0.868 0.856 1.000 0.846 CA 1.564 14 residues pruned to eliminate duplicates 6 1.690 1.674 -0.053 0.140 0.600 0.200 CB 1.242 ? Z: 9 6.811 1.867 -0.128 0.454 1.000 0.625 CB 1.551 Z: 11 15.039 1.796 0.461 0.803 1.000 0.700 CA 1.391 11 residues pruned to eliminate duplicates Z: 27 16.799 2.033 0.511 0.505 0.808 0.423 CB 1.321 27 residues pruned to eliminate duplicates Z: 9 12.229 1.809 0.434 0.903 1.000 0.750 CB 1.188 9 residues pruned to eliminate duplicates Z: 15 32.432 2.211 0.957 0.950 1.000 0.857 CB 1.382 15 residues pruned to eliminate duplicates Z: 13 17.438 1.957 0.637 0.917 1.000 0.833 CB 1.109 13 residues pruned to eliminate duplicates Z: 16 35.703 2.181 1.044 0.845 0.933 0.867 CB 1.647 16 residues pruned to eliminate duplicates Z: 27 22.766 2.092 0.733 0.493 0.808 0.346 CA 1.535 27 residues pruned to eliminate duplicates Z: 9 22.805 2.155 1.066 0.796 1.000 0.875 CB 1.398 9 residues pruned to eliminate duplicates Z: 8 3.949 1.580 -0.081 0.517 0.857 0.286 C 1.179 Z: 15 20.566 1.788 0.564 0.893 1.000 0.714 CA 1.412 15 residues pruned to eliminate duplicates Z: 150 74.862 2.160 0.819 0.583 0.919 0.597 CB 1.568 150 residues pruned to eliminate duplicates Z: 16 10.733 1.862 0.458 0.372 0.800 0.333 CB 1.463 16 residues pruned to eliminate duplicates Z: 10 8.207 1.790 0.564 0.426 0.778 0.556 CA 1.356 12 residues pruned to eliminate duplicates Z: 16 24.199 2.011 0.671 0.880 0.933 0.733 CB 1.444 16 residues pruned to eliminate duplicates Z: 83 61.279 2.260 0.863 0.533 0.976 0.573 CB 1.595 83 residues pruned to eliminate duplicates Z: 144 96.605 2.287 1.068 0.639 0.951 0.601 CB 1.577 144 residues pruned to eliminate duplicates Z: 6 4.865 1.854 -0.173 0.556 1.000 0.400 CB 1.343 Z: 25 25.556 2.106 0.748 0.476 0.917 0.542 CB 1.583 25 residues pruned to eliminate duplicates Z: 15 17.208 1.784 0.625 0.877 0.929 0.786 CB 1.241 15 residues pruned to eliminate duplicates Z: 17 29.514 2.025 0.816 0.907 1.000 0.938 CB 1.427 17 residues pruned to eliminate duplicates Z: 11 7.268 1.771 0.603 0.324 0.700 0.500 CA 1.405 11 residues pruned to eliminate duplicates Z: 7 6.441 1.702 0.535 0.769 0.833 0.667 CB 0.951 6 residues pruned to eliminate duplicates Z: 22 26.221 2.092 0.953 0.511 0.952 0.619 CB 1.454 22 residues pruned to eliminate duplicates Z: 10 12.129 2.009 0.473 0.638 0.889 0.556 CA 1.351 10 residues pruned to eliminate duplicates 6 1.968 1.947 -0.122 0.396 0.800 0.400 CB 0.718 ? Z: 84 63.108 2.222 0.906 0.634 0.952 0.627 CB 1.514 84 residues pruned to eliminate duplicates Z: 33 22.361 2.104 0.553 0.429 0.906 0.562 CB 1.436 33 residues pruned to eliminate duplicates Z: 17 39.966 2.053 1.313 0.881 1.000 0.562 CB 1.524 17 residues pruned to eliminate duplicates Z: 36 34.330 2.103 0.809 0.635 0.914 0.686 CB 1.470 36 residues pruned to eliminate duplicates Z: 16 25.642 2.019 0.680 0.891 1.000 0.267 CB 1.403 16 residues pruned to eliminate duplicates Z: 35 40.224 2.195 0.962 0.605 0.941 0.676 CB 1.540 35 residues pruned to eliminate duplicates Z: 42 31.445 2.013 0.756 0.663 0.878 0.659 CB 1.361 42 residues pruned to eliminate duplicates 6 1.649 1.651 -0.474 0.493 0.800 0.800 C 1.069 ? Z: 10 13.529 1.979 0.520 0.721 0.889 0.556 CB 1.382 10 residues pruned to eliminate duplicates Z: 14 25.872 2.114 0.908 0.900 0.923 0.615 CA 1.376 14 residues pruned to eliminate duplicates Z: 32 36.769 2.251 0.727 0.578 0.935 0.548 CB 1.685 32 residues pruned to eliminate duplicates Z: 16 14.793 1.781 0.511 0.565 0.933 0.533 CA 1.428 15 residues pruned to eliminate duplicates Z: 19 18.943 2.087 0.557 0.500 0.889 0.611 CB 1.545 19 residues pruned to eliminate duplicates Z: 54 61.715 2.380 1.075 0.623 0.887 0.679 CB 1.724 54 residues pruned to eliminate duplicates Z: 14 47.289 2.360 1.203 0.905 1.000 0.692 CA 1.796 14 residues pruned to eliminate duplicates Z: 51 47.435 2.136 0.919 0.659 0.940 0.680 CB 1.503 51 residues pruned to eliminate duplicates Z: 10 16.576 2.044 0.912 0.734 0.778 0.667 CB 1.473 10 residues pruned to eliminate duplicates Z: 47 27.839 2.135 0.632 0.440 0.826 0.522 CB 1.518 47 residues pruned to eliminate duplicates Z: 9 20.785 2.169 0.760 0.912 1.000 1.000 CB 1.363 9 residues pruned to eliminate duplicates Z: 139 84.554 2.212 0.856 0.639 0.964 0.652 CB 1.596 139 residues pruned to eliminate duplicates Z: 12 4.541 1.795 0.399 0.287 0.636 0.545 CB 1.089 12 residues pruned to eliminate duplicates Z: 15 16.483 1.753 0.453 0.930 1.000 0.857 CA 1.209 15 residues pruned to eliminate duplicates Z: 15 32.928 2.281 0.659 0.909 1.000 0.929 CA 1.651 15 residues pruned to eliminate duplicates Z: 6 3.230 1.719 0.163 0.575 0.600 0.400 CB 1.120 Z: 7 13.041 1.970 0.586 0.685 1.000 0.500 C 1.439 7 residues pruned to eliminate duplicates Z: 13 27.808 2.303 1.413 0.524 0.917 0.667 CB 1.539 13 residues pruned to eliminate duplicates Z: 209 102.273 2.266 0.956 0.595 0.942 0.611 CB 1.550 209 residues pruned to eliminate duplicates Z: 8 21.051 2.329 0.819 0.892 0.857 0.714 CB 1.574 8 residues pruned to eliminate duplicates Z: 10 3.884 1.685 -0.194 0.486 0.889 0.444 CB 1.088 Z: 14 12.954 1.847 0.891 0.382 0.923 0.538 CA 1.263 Z: 79 75.594 2.396 1.063 0.622 0.910 0.679 CB 1.696 78 residues pruned to eliminate duplicates Z: 41 49.893 2.269 1.111 0.673 0.875 0.650 CB 1.604 41 residues pruned to eliminate duplicates Z: 83 73.612 2.350 1.001 0.639 0.951 0.622 CB 1.596 83 residues pruned to eliminate duplicates Z: 8 10.103 1.690 0.788 0.619 0.857 0.857 CA 1.318 8 residues pruned to eliminate duplicates Z: 18 12.915 1.713 0.444 0.543 0.941 0.529 CB 1.289 18 residues pruned to eliminate duplicates Z: 42 16.942 1.763 0.541 0.390 0.854 0.512 CB 1.282 41 residues pruned to eliminate duplicates Z: 63 58.721 2.277 1.035 0.587 0.968 0.613 CB 1.530 63 residues pruned to eliminate duplicates Z: 10 14.789 1.746 0.662 0.792 1.000 0.333 CA 1.315 10 residues pruned to eliminate duplicates Z: 24 20.615 2.014 0.628 0.486 0.870 0.565 CB 1.530 24 residues pruned to eliminate duplicates Z: 15 18.297 2.011 0.610 0.897 0.786 0.571 CB 1.375 15 residues pruned to eliminate duplicates Z: 16 32.693 2.132 0.862 0.906 1.000 0.733 CA 1.512 16 residues pruned to eliminate duplicates Z: 16 16.639 1.910 0.246 0.789 1.000 0.867 CB 1.400 16 residues pruned to eliminate duplicates Z: 9 6.308 1.410 0.163 0.863 1.000 0.875 CB 0.997 9 residues pruned to eliminate duplicates Z: 10 16.780 1.888 0.670 0.879 1.000 1.000 CA 1.287 10 residues pruned to eliminate duplicates Z: 6 6.071 1.782 0.035 0.661 1.000 1.000 N 1.267 5 residues pruned to eliminate duplicates Z: 7 5.356 1.835 -0.004 0.577 0.833 0.500 CA 1.334 7 residues pruned to eliminate duplicates Z: 84 69.822 2.221 0.973 0.654 0.952 0.651 CB 1.592 84 residues pruned to eliminate duplicates Z: 9 16.684 1.813 1.158 0.896 0.875 0.500 CA 1.234 9 residues pruned to eliminate duplicates Z: 12 7.902 1.827 0.329 0.439 0.818 0.636 CB 1.277 12 residues pruned to eliminate duplicates Z: 26 17.861 1.801 0.947 0.404 0.880 0.520 CB 1.280 26 residues pruned to eliminate duplicates Z: 15 49.448 2.365 1.277 0.938 1.000 0.714 CB 1.706 15 residues pruned to eliminate duplicates Z: 42 37.882 2.083 0.719 0.679 0.878 0.659 CB 1.597 42 residues pruned to eliminate duplicates Z: 25 24.690 2.081 0.625 0.661 0.917 0.417 CB 1.401 25 residues pruned to eliminate duplicates Z: 109 83.346 2.352 0.995 0.622 0.926 0.648 CB 1.644 109 residues pruned to eliminate duplicates Z: 16 33.989 2.190 1.079 0.879 0.933 0.533 CB 1.498 16 residues pruned to eliminate duplicates Z: 8 12.928 2.027 0.502 0.786 0.857 0.571 CA 1.456 8 residues pruned to eliminate duplicates Z: 83 77.778 2.312 1.046 0.658 0.951 0.634 CB 1.648 83 residues pruned to eliminate duplicates Z: 50 47.612 2.236 0.895 0.630 0.898 0.673 CB 1.582 50 residues pruned to eliminate duplicates Z: 83 67.896 2.359 0.970 0.574 0.915 0.634 CB 1.642 83 residues pruned to eliminate duplicates Z: 29 42.608 2.330 1.018 0.556 0.964 0.679 CA 1.682 37 residues pruned to eliminate duplicates Z: 16 15.144 1.874 0.198 0.803 1.000 0.533 CA 1.337 16 residues pruned to eliminate duplicates Z: 14 23.149 2.296 0.526 0.898 0.846 0.846 CB 1.548 14 residues pruned to eliminate duplicates Z: 6 9.952 1.819 0.523 0.871 1.000 0.400 CA 1.172 Z: 13 27.989 2.431 0.775 0.695 1.000 0.750 CA 1.567 13 residues pruned to eliminate duplicates Z: 16 31.788 2.303 0.746 0.616 1.000 0.467 CB 1.829 16 residues pruned to eliminate duplicates Z: 7 8.505 1.752 0.557 0.610 0.833 0.667 CA 1.377 7 residues pruned to eliminate duplicates Z: 16 31.478 2.064 1.090 0.883 0.933 0.800 CA 1.460 16 residues pruned to eliminate duplicates Z: 8 11.169 1.727 0.495 0.867 1.000 0.714 C 1.197 8 residues pruned to eliminate duplicates Z: 17 24.772 2.093 1.020 0.796 0.875 0.625 CB 1.291 17 residues pruned to eliminate duplicates Z: 15 30.902 2.189 0.713 0.922 1.000 0.857 CA 1.549 15 residues pruned to eliminate duplicates Z: 16 27.339 2.006 0.850 0.883 1.000 0.800 CB 1.375 16 residues pruned to eliminate duplicates Z: 9 16.660 2.155 0.522 0.830 0.875 0.875 CA 1.543 9 residues pruned to eliminate duplicates Z: 15 24.303 2.171 0.457 0.906 1.000 0.786 CA 1.460 15 residues pruned to eliminate duplicates Z: 9 8.368 1.976 0.186 0.527 0.750 0.375 CB 1.638 9 residues pruned to eliminate duplicates Z: 9 7.702 1.983 0.419 0.417 0.750 0.625 CA 1.407 9 residues pruned to eliminate duplicates Z: 10 19.789 2.249 0.344 0.928 1.000 1.000 CB 1.528 10 residues pruned to eliminate duplicates Z: 11 7.678 1.617 0.587 0.460 0.900 0.600 CB 1.095 Z: 9 3.232 1.628 0.218 0.255 0.625 0.500 C 1.222 Z: 37 43.937 2.460 0.886 0.584 0.889 0.611 CB 1.638 37 residues pruned to eliminate duplicates Z: 20 20.617 1.909 0.647 0.726 0.947 0.526 CB 1.295 20 residues pruned to eliminate duplicates Z: 9 10.428 1.818 0.524 0.887 1.000 0.625 CB 0.959 9 residues pruned to eliminate duplicates Z: 16 32.559 2.136 0.811 0.908 1.000 0.867 CA 1.543 16 residues pruned to eliminate duplicates Z: 6 2.958 1.309 0.378 0.468 1.000 0.600 CA 0.758 Z: 12 24.700 2.220 1.058 0.679 0.909 0.636 CB 1.521 12 residues pruned to eliminate duplicates Z: 10 3.201 1.450 0.594 0.422 0.556 0.222 CA 0.901 Z: 57 67.909 2.363 1.164 0.614 0.946 0.679 CB 1.684 57 residues pruned to eliminate duplicates Z: 99 54.626 2.089 0.842 0.531 0.898 0.582 CB 1.550 99 residues pruned to eliminate duplicates Z: 14 18.233 2.115 0.745 0.537 0.923 0.538 CA 1.431 14 residues pruned to eliminate duplicates Z: 14 18.735 1.967 0.652 0.928 1.000 0.923 CB 1.120 14 residues pruned to eliminate duplicates Z: 9 4.820 1.776 -0.098 0.596 0.625 0.500 C 1.553 6 residues pruned to eliminate duplicates Z: 14 13.028 1.940 0.623 0.471 0.846 0.538 CA 1.396 14 residues pruned to eliminate duplicates Z: 53 24.214 2.130 0.601 0.339 0.808 0.538 CB 1.454 53 residues pruned to eliminate duplicates Z: 16 8.565 2.107 0.386 0.271 0.667 0.267 CB 1.474 16 residues pruned to eliminate duplicates Z: 17 24.337 2.029 0.668 0.852 0.938 0.562 CA 1.418 17 residues pruned to eliminate duplicates Z: 19 17.602 1.865 0.551 0.547 0.944 0.611 CB 1.451 19 residues pruned to eliminate duplicates Z: 84 70.878 2.275 0.992 0.648 0.928 0.627 CB 1.613 84 residues pruned to eliminate duplicates Z: 73 67.081 2.330 1.008 0.632 0.903 0.681 CB 1.653 73 residues pruned to eliminate duplicates Z: 8 10.136 1.662 0.819 0.792 0.857 0.714 CB 1.145 8 residues pruned to eliminate duplicates Z: 85 74.924 2.283 1.075 0.637 0.929 0.619 CB 1.634 85 residues pruned to eliminate duplicates Z: 15 32.801 2.198 1.289 0.929 1.000 0.714 CB 1.219 15 residues pruned to eliminate duplicates Z: 11 7.430 1.680 0.264 0.641 0.900 0.500 CB 1.078 11 residues pruned to eliminate duplicates Z: 10 4.938 1.480 0.385 0.440 0.667 0.444 N 1.281 Z: 7 7.682 1.857 0.397 0.738 0.833 0.333 CA 1.172 6 residues pruned to eliminate duplicates Z: 38 37.841 2.196 0.779 0.679 0.892 0.649 CB 1.514 38 residues pruned to eliminate duplicates Z: 6 4.102 1.598 0.119 0.490 0.800 0.800 C 1.295 Z: 24 28.100 2.157 0.747 0.552 0.957 0.696 CB 1.546 24 residues pruned to eliminate duplicates Z: 8 6.231 1.601 0.682 0.685 0.857 0.571 CB 0.861 8 residues pruned to eliminate duplicates Z: 26 25.823 2.124 0.947 0.437 0.920 0.560 CB 1.449 26 residues pruned to eliminate duplicates Z: 30 30.131 2.187 0.846 0.554 0.931 0.759 CB 1.412 30 residues pruned to eliminate duplicates Z: 14 8.294 1.691 0.480 0.476 0.769 0.538 CB 1.224 10 residues pruned to eliminate duplicates Z: 20 25.501 2.068 0.957 0.545 0.947 0.632 CB 1.460 20 residues pruned to eliminate duplicates Z: 7 6.157 1.645 -0.036 0.770 1.000 0.667 CB 1.248 7 residues pruned to eliminate duplicates Z: 13 12.756 2.167 0.483 0.732 0.833 0.583 CB 1.116 13 residues pruned to eliminate duplicates Z: 13 18.689 1.963 0.553 0.734 1.000 0.583 CB 1.434 13 residues pruned to eliminate duplicates Z: 120 77.877 2.221 0.946 0.614 0.924 0.630 CB 1.603 126 residues pruned to eliminate duplicates Z: 6 3.064 1.501 0.356 0.396 0.600 0.400 N 1.252 6 residues pruned to eliminate duplicates Z: 114 76.848 2.233 0.907 0.639 0.938 0.655 CB 1.588 114 residues pruned to eliminate duplicates Z: 8 2.532 1.444 0.205 0.315 0.714 0.429 CB 0.945 Z: 6 3.355 1.753 0.232 0.241 1.000 0.200 CB 0.937 6 residues pruned to eliminate duplicates Z: 10 5.160 1.468 0.112 0.828 1.000 0.889 CB 0.794 10 residues pruned to eliminate duplicates Z: 20 24.505 2.123 0.901 0.499 0.947 0.789 CB 1.471 20 residues pruned to eliminate duplicates Z: 103 70.512 2.332 0.889 0.559 0.922 0.637 CB 1.624 103 residues pruned to eliminate duplicates Z: 7 6.633 1.665 0.063 0.773 1.000 0.667 CB 1.203 7 residues pruned to eliminate duplicates Z: 15 29.604 2.168 0.763 0.913 1.000 0.857 CA 1.465 15 residues pruned to eliminate duplicates Z: 22 9.388 1.626 0.615 0.472 0.857 0.619 CB 0.937 10 residues pruned to eliminate duplicates Z: 15 15.377 2.168 0.768 0.295 0.929 0.643 CA 1.453 15 residues pruned to eliminate duplicates Z: 84 70.167 2.264 0.975 0.658 0.952 0.675 CB 1.562 84 residues pruned to eliminate duplicates Z: 57 51.422 2.188 0.906 0.607 0.946 0.643 CB 1.572 63 residues pruned to eliminate duplicates Z: 6 7.730 1.644 0.080 0.859 1.000 1.000 N 1.433 Z: 16 10.847 2.052 0.644 0.287 0.867 0.333 CA 1.218 23 residues pruned to eliminate duplicates Z: 9 3.238 1.449 0.074 0.448 0.875 0.750 CB 0.887 9 residues pruned to eliminate duplicates Z: 71 53.026 2.150 0.745 0.649 0.929 0.657 CB 1.583 71 residues pruned to eliminate duplicates Z: 10 17.074 2.037 0.527 0.779 1.000 0.778 CA 1.431 10 residues pruned to eliminate duplicates Z: 7 9.291 1.854 0.659 0.743 1.000 0.667 CA 0.993 7 residues pruned to eliminate duplicates Z: 9 7.725 1.527 0.176 0.842 1.000 1.000 CB 1.134 9 residues pruned to eliminate duplicates Z: 64 49.817 2.159 0.993 0.560 0.889 0.587 CB 1.548 64 residues pruned to eliminate duplicates Z: 30 39.054 2.263 0.899 0.543 0.931 0.586 CA 1.737 30 residues pruned to eliminate duplicates Z: 14 11.359 1.969 0.393 0.389 0.923 0.538 CB 1.399 13 residues pruned to eliminate duplicates Z: 101 77.355 2.251 0.961 0.637 0.940 0.650 CB 1.640 101 residues pruned to eliminate duplicates Z: 13 6.592 1.674 0.855 0.249 0.750 0.333 CA 1.090 13 residues pruned to eliminate duplicates Z: 30 31.829 2.274 1.018 0.503 0.828 0.517 CA 1.551 30 residues pruned to eliminate duplicates Z: 9 4.888 1.645 0.274 0.383 0.875 0.500 CB 1.068 Z: 60 62.787 2.325 1.095 0.576 0.949 0.593 CB 1.642 60 residues pruned to eliminate duplicates 6 1.865 1.467 0.299 0.299 0.800 0.600 CB 0.685 ? Z: 10 6.339 1.758 0.180 0.422 0.778 0.667 N 1.419 13 residues pruned to eliminate duplicates Z: 10 13.994 1.684 0.837 0.854 1.000 0.889 CA 1.114 10 residues pruned to eliminate duplicates Z: 14 39.764 2.282 1.254 0.935 1.000 0.923 CB 1.494 14 residues pruned to eliminate duplicates Z: 25 17.260 1.826 0.951 0.394 0.875 0.542 CB 1.265 25 residues pruned to eliminate duplicates Z: 7 9.449 1.992 0.401 0.629 0.833 0.833 CA 1.469 7 residues pruned to eliminate duplicates Z: 112 83.928 2.304 1.003 0.658 0.937 0.694 CB 1.590 112 residues pruned to eliminate duplicates Z: 46 45.100 2.288 0.907 0.596 0.844 0.556 CB 1.665 46 residues pruned to eliminate duplicates Z: 64 47.015 2.190 0.805 0.474 0.968 0.619 CB 1.589 64 residues pruned to eliminate duplicates Z: 18 17.436 2.038 0.580 0.540 0.941 0.529 CB 1.342 18 residues pruned to eliminate duplicates Z: 70 59.415 2.385 0.913 0.542 0.913 0.652 CB 1.647 70 residues pruned to eliminate duplicates Z: 95 77.622 2.302 1.039 0.613 0.926 0.596 CB 1.657 95 residues pruned to eliminate duplicates Z: 115 86.705 2.415 1.027 0.543 0.930 0.596 CB 1.710 115 residues pruned to eliminate duplicates Z: 88 64.183 2.304 0.817 0.568 0.931 0.621 CB 1.653 88 residues pruned to eliminate duplicates Z: 16 33.966 2.129 1.038 0.911 1.000 0.733 CB 1.433 16 residues pruned to eliminate duplicates Z: 13 15.589 1.960 0.413 0.768 0.917 0.750 CA 1.397 13 residues pruned to eliminate duplicates Z: 25 31.419 2.319 0.950 0.608 0.833 0.542 CB 1.537 25 residues pruned to eliminate duplicates Z: 14 49.290 2.380 1.161 0.931 1.000 0.538 CB 1.857 14 residues pruned to eliminate duplicates Z: 15 34.484 2.283 0.913 0.855 1.000 0.786 CA 1.558 15 residues pruned to eliminate duplicates Z: 14 46.364 2.376 1.340 0.901 0.923 0.846 CA 1.788 14 residues pruned to eliminate duplicates Z: 15 30.347 2.062 0.784 0.933 1.000 0.500 CB 1.539 15 residues pruned to eliminate duplicates Z: 17 26.334 2.236 0.783 0.625 0.875 0.812 CA 1.678 17 residues pruned to eliminate duplicates Z: 52 39.651 2.128 0.706 0.563 0.941 0.725 CB 1.528 52 residues pruned to eliminate duplicates Z: 6 3.344 1.177 0.280 0.547 1.000 0.800 N 0.948 Z: 14 32.812 2.130 0.973 0.855 1.000 0.692 CB 1.598 14 residues pruned to eliminate duplicates Z: 10 6.568 1.760 0.034 0.482 1.000 0.444 CB 1.224 5 residues pruned to eliminate duplicates Z: 12 40.578 2.463 0.775 0.927 1.000 0.182 CB 1.961 12 residues pruned to eliminate duplicates Z: 10 17.364 2.003 1.288 0.427 1.000 0.556 CB 1.362 10 residues pruned to eliminate duplicates Z: 7 6.827 1.754 0.226 0.835 0.833 0.667 CB 1.165 7 residues pruned to eliminate duplicates Z: 8 3.445 1.624 -0.143 0.644 0.857 0.714 CB 0.954 8 residues pruned to eliminate duplicates Z: 50 41.309 2.291 0.858 0.457 0.898 0.694 CB 1.614 50 residues pruned to eliminate duplicates Z: 18 19.020 1.929 0.379 0.874 0.941 0.706 CA 1.340 18 residues pruned to eliminate duplicates Z: 17 39.989 2.247 1.048 0.907 1.000 0.688 CB 1.544 17 residues pruned to eliminate duplicates Z: 19 18.738 2.127 0.577 0.472 0.889 0.611 CB 1.524 19 residues pruned to eliminate duplicates Z: 15 19.375 2.090 0.862 0.572 0.857 0.643 CB 1.448 15 residues pruned to eliminate duplicates Z: 52 63.984 2.378 1.054 0.646 0.941 0.549 CB 1.700 52 residues pruned to eliminate duplicates Z: 34 29.797 2.110 0.825 0.472 0.909 0.485 CB 1.525 34 residues pruned to eliminate duplicates Z: 101 66.746 2.371 0.871 0.502 0.950 0.580 CB 1.580 101 residues pruned to eliminate duplicates Z: 9 6.480 1.553 0.258 0.733 1.000 1.000 CB 0.951 9 residues pruned to eliminate duplicates Z: 9 17.542 1.897 0.730 0.860 1.000 0.625 CA 1.390 9 residues pruned to eliminate duplicates Z: 13 33.810 2.223 0.931 0.844 0.917 0.667 CA 1.846 13 residues pruned to eliminate duplicates Z: 15 21.707 2.149 0.254 0.934 1.000 1.000 CB 1.501 15 residues pruned to eliminate duplicates Z: 7 3.989 1.667 -0.064 0.530 1.000 0.667 CB 1.013 Z: 39 20.682 2.096 0.545 0.341 0.763 0.553 CB 1.614 40 residues pruned to eliminate duplicates Z: 14 11.810 1.934 0.899 0.313 0.846 0.462 CA 1.297 14 residues pruned to eliminate duplicates Z: 73 55.227 2.182 0.863 0.641 0.917 0.569 CB 1.530 73 residues pruned to eliminate duplicates Z: 26 34.522 2.285 1.165 0.606 0.840 0.600 CB 1.503 26 residues pruned to eliminate duplicates Z: 31 55.456 2.461 1.125 0.666 0.933 0.600 CB 1.779 31 residues pruned to eliminate duplicates Z: 10 8.075 1.858 0.775 0.566 0.778 0.778 CB 0.985 10 residues pruned to eliminate duplicates Z: 8 10.756 1.973 1.000 0.454 0.714 0.714 CA 1.512 8 residues pruned to eliminate duplicates Z: 18 27.349 2.307 0.910 0.478 1.000 0.647 CA 1.539 18 residues pruned to eliminate duplicates Z: 12 43.202 2.266 1.491 0.897 1.000 0.818 CA 1.652 12 residues pruned to eliminate duplicates Z: 10 7.263 1.516 0.454 0.732 1.000 0.444 CB 0.891 9 residues pruned to eliminate duplicates Z: 61 55.300 2.254 1.031 0.613 0.867 0.600 CB 1.616 61 residues pruned to eliminate duplicates Z: 9 28.785 2.311 1.035 0.738 1.000 0.625 CA 1.749 9 residues pruned to eliminate duplicates Z: 12 13.994 1.820 0.621 0.481 1.000 0.727 CB 1.458 12 residues pruned to eliminate duplicates Z: 9 6.775 1.659 0.087 0.739 1.000 0.500 CB 1.071 9 residues pruned to eliminate duplicates Z: 25 13.005 1.658 0.404 0.644 0.958 0.583 CB 1.040 25 residues pruned to eliminate duplicates Z: 17 36.908 2.260 0.764 0.903 1.000 0.750 CB 1.650 17 residues pruned to eliminate duplicates Z: 22 38.087 2.390 0.911 0.638 0.857 0.714 CA 1.866 22 residues pruned to eliminate duplicates Z: 8 3.048 1.412 0.452 0.362 0.857 0.714 CB 0.760 Z: 84 65.150 2.207 0.898 0.654 0.976 0.639 CB 1.515 84 residues pruned to eliminate duplicates Z: 11 3.519 1.659 0.115 0.308 0.700 0.200 CB 1.063 11 residues pruned to eliminate duplicates Z: 31 36.469 2.119 1.187 0.542 0.900 0.400 CB 1.533 31 residues pruned to eliminate duplicates Z: 8 10.199 1.551 0.917 0.801 1.000 0.571 CA 0.997 8 residues pruned to eliminate duplicates Z: 26 36.878 2.439 0.955 0.524 0.880 0.600 CB 1.716 26 residues pruned to eliminate duplicates Z: 10 6.429 1.518 0.479 0.815 0.889 0.556 CB 0.817 10 residues pruned to eliminate duplicates Z: 9 2.495 1.612 0.241 0.186 0.625 0.375 CB 1.028 Z: 30 28.083 2.280 0.706 0.511 0.862 0.586 CB 1.538 30 residues pruned to eliminate duplicates Z: 15 42.192 2.507 1.066 0.776 0.929 0.786 CA 1.838 15 residues pruned to eliminate duplicates Z: 16 25.883 2.044 0.632 0.901 0.933 0.800 CB 1.533 16 residues pruned to eliminate duplicates Z: 15 28.538 2.148 0.654 0.894 1.000 0.857 CA 1.540 15 residues pruned to eliminate duplicates Z: 44 45.166 2.172 0.884 0.684 0.953 0.605 CB 1.491 44 residues pruned to eliminate duplicates Z: 10 3.980 1.254 0.176 0.746 1.000 0.667 CB 0.722 7 residues pruned to eliminate duplicates Z: 10 6.775 1.575 0.122 0.850 0.889 0.778 CB 1.065 10 residues pruned to eliminate duplicates Z: 61 35.738 2.023 0.764 0.508 0.917 0.683 CB 1.400 51 residues pruned to eliminate duplicates Z: 9 13.189 1.960 0.742 0.418 1.000 0.500 CB 1.488 9 residues pruned to eliminate duplicates Z: 17 39.530 2.306 1.048 0.909 1.000 0.500 CB 1.485 17 residues pruned to eliminate duplicates Z: 9 3.898 1.388 0.406 0.363 0.875 0.375 CA 0.936 Z: 32 40.098 2.291 0.751 0.604 0.968 0.645 CB 1.680 32 residues pruned to eliminate duplicates Z: 16 17.074 1.953 0.984 0.439 0.800 0.600 CA 1.516 16 residues pruned to eliminate duplicates Z: 15 4.935 1.741 0.099 0.352 0.857 0.286 CB 0.945 11 residues pruned to eliminate duplicates Z: 11 6.515 1.754 0.665 0.323 0.700 0.300 CB 1.225 11 residues pruned to eliminate duplicates Z: 10 6.697 1.780 0.127 0.491 0.778 0.444 C 1.444 10 residues pruned to eliminate duplicates Z: 15 36.012 2.120 1.248 0.915 1.000 0.857 CB 1.427 15 residues pruned to eliminate duplicates Z: 6 2.082 1.141 0.226 0.284 1.000 0.800 CB 0.849 Z: 138 82.522 2.213 0.910 0.624 0.942 0.599 CB 1.576 138 residues pruned to eliminate duplicates Z: 7 8.661 1.866 0.846 0.689 0.833 0.833 N 1.036 Z: 30 35.798 2.201 0.907 0.593 0.862 0.586 CB 1.681 30 residues pruned to eliminate duplicates Z: 15 42.677 2.417 1.194 0.918 0.929 0.500 CB 1.633 15 residues pruned to eliminate duplicates Z: 9 8.026 1.558 0.408 0.825 1.000 0.625 CB 0.976 9 residues pruned to eliminate duplicates Z: 10 4.896 1.977 0.024 0.273 0.889 0.556 CA 1.173 Z: 82 42.024 2.089 0.650 0.498 0.901 0.580 CB 1.506 82 residues pruned to eliminate duplicates Z: 11 20.371 2.020 0.846 0.754 0.900 0.600 CB 1.530 11 residues pruned to eliminate duplicates Z: 11 21.671 2.092 0.516 0.868 1.000 1.000 CA 1.579 11 residues pruned to eliminate duplicates Z: 6 2.670 1.484 -0.138 0.612 0.800 0.400 CB 1.049 Z: 82 60.605 2.260 0.768 0.633 0.938 0.642 CB 1.585 82 residues pruned to eliminate duplicates Z: 33 39.146 2.314 0.820 0.637 0.875 0.688 CA 1.651 33 residues pruned to eliminate duplicates Z: 14 20.969 2.245 0.722 0.529 1.000 0.769 CA 1.462 14 residues pruned to eliminate duplicates Z: 9 4.453 1.874 0.303 0.202 0.875 0.375 CB 1.049 9 residues pruned to eliminate duplicates Z: 6 4.766 1.821 -0.312 0.791 1.000 0.800 O 1.318 Z: 132 97.978 2.422 0.960 0.638 0.931 0.634 CB 1.702 132 residues pruned to eliminate duplicates Z: 55 32.581 2.081 0.681 0.501 0.907 0.537 CB 1.395 55 residues pruned to eliminate duplicates Z: 104 66.458 2.221 1.009 0.571 0.893 0.612 CB 1.534 104 residues pruned to eliminate duplicates Z: 108 86.770 2.345 0.962 0.634 0.963 0.664 CB 1.670 108 residues pruned to eliminate duplicates Z: 87 51.243 2.214 0.836 0.487 0.919 0.663 CB 1.500 87 residues pruned to eliminate duplicates Z: 39 28.190 2.182 0.519 0.498 0.921 0.421 CB 1.501 49 residues pruned to eliminate duplicates Z: 7 2.544 1.523 0.037 0.354 0.667 0.500 C 1.155 3 residues pruned to eliminate duplicates Z: 7 5.266 1.627 0.738 0.453 0.833 0.500 N 0.957 Z: 11 24.075 2.145 0.829 0.714 1.000 0.800 CA 1.598 11 residues pruned to eliminate duplicates Z: 7 19.121 2.026 0.900 0.733 1.000 0.833 CB 1.645 7 residues pruned to eliminate duplicates Z: 11 19.488 2.080 0.834 0.602 1.000 0.600 CA 1.466 11 residues pruned to eliminate duplicates Z: 21 26.328 2.288 0.698 0.512 0.950 0.800 CB 1.576 21 residues pruned to eliminate duplicates Z: 68 42.255 2.224 0.824 0.485 0.896 0.567 CB 1.442 68 residues pruned to eliminate duplicates Z: 86 63.044 2.252 0.928 0.601 0.894 0.576 CB 1.601 86 residues pruned to eliminate duplicates Z: 15 39.177 2.120 1.167 0.921 1.000 0.786 CA 1.604 15 residues pruned to eliminate duplicates Z: 6 7.821 1.558 0.668 0.588 1.000 0.800 CB 1.237 Z: 31 38.534 2.156 0.865 0.676 0.967 0.633 CB 1.539 31 residues pruned to eliminate duplicates Z: 16 7.187 1.484 0.316 0.461 0.867 0.600 CB 1.140 14 residues pruned to eliminate duplicates Z: 9 11.775 1.759 0.558 0.873 1.000 0.750 CB 1.106 9 residues pruned to eliminate duplicates Z: 55 70.229 2.466 1.027 0.635 0.981 0.574 CB 1.717 55 residues pruned to eliminate duplicates Z: 8 14.019 2.053 0.661 0.873 0.857 0.714 CB 1.321 8 residues pruned to eliminate duplicates Z: 34 31.530 2.206 0.808 0.513 0.909 0.576 CB 1.494 34 residues pruned to eliminate duplicates Z: 131 91.987 2.390 0.925 0.615 0.923 0.631 CB 1.703 131 residues pruned to eliminate duplicates Z: 15 34.919 2.098 1.054 0.919 1.000 0.714 CA 1.526 15 residues pruned to eliminate duplicates Z: 8 8.438 1.612 0.420 0.822 1.000 0.714 CA 1.054 12 residues pruned to eliminate duplicates Z: 15 13.184 2.070 0.582 0.396 0.857 0.429 CB 1.401 15 residues pruned to eliminate duplicates Z: 19 9.935 1.946 0.492 0.196 0.778 0.444 CB 1.490 19 residues pruned to eliminate duplicates Z: 8 10.477 1.770 0.682 0.841 0.857 0.429 CB 1.157 9 residues pruned to eliminate duplicates Z: 28 34.617 2.096 0.859 0.749 0.963 0.630 CB 1.422 28 residues pruned to eliminate duplicates Z: 86 85.405 2.412 1.125 0.605 0.953 0.600 CB 1.716 86 residues pruned to eliminate duplicates Z: 83 77.350 2.351 1.000 0.670 0.963 0.585 CB 1.612 83 residues pruned to eliminate duplicates Z: 16 22.244 2.010 0.921 0.556 0.933 0.600 CA 1.509 16 residues pruned to eliminate duplicates Z: 12 24.648 2.140 0.922 0.734 1.000 0.727 CB 1.465 12 residues pruned to eliminate duplicates Z: 6 6.003 1.828 0.462 0.676 1.000 0.800 CB 0.854 Z: 28 30.281 2.186 0.983 0.555 0.889 0.667 CB 1.433 28 residues pruned to eliminate duplicates Z: 9 9.936 1.634 0.298 0.892 1.000 0.750 CB 1.190 10 residues pruned to eliminate duplicates Z: 53 49.934 2.318 1.006 0.508 0.962 0.692 CB 1.536 53 residues pruned to eliminate duplicates Z: 19 9.746 1.678 0.425 0.316 0.944 0.556 CA 1.246 20 residues pruned to eliminate duplicates Z: 86 66.889 2.214 0.896 0.638 0.941 0.635 CB 1.613 86 residues pruned to eliminate duplicates Z: 9 7.208 1.614 0.801 0.380 0.750 0.750 CB 1.328 Z: 10 21.885 1.978 1.283 0.850 0.889 0.444 CB 1.346 10 residues pruned to eliminate duplicates Z: 19 15.456 1.924 0.732 0.478 0.889 0.444 CB 1.258 19 residues pruned to eliminate duplicates Z: 6 11.366 1.684 1.003 0.786 1.000 0.800 N 1.172 6 residues pruned to eliminate duplicates Z: 8 3.624 1.585 0.267 0.346 0.857 0.571 CA 0.941 Z: 43 18.213 1.804 0.495 0.496 0.857 0.619 CB 1.221 43 residues pruned to eliminate duplicates Z: 8 10.926 1.802 0.510 0.798 1.000 0.857 CA 1.169 8 residues pruned to eliminate duplicates Z: 6 3.247 1.343 0.500 0.295 0.800 0.600 C 1.134 Z: 31 19.518 1.956 0.400 0.555 0.900 0.600 CB 1.370 31 residues pruned to eliminate duplicates Z: 10 18.873 2.230 0.261 0.886 1.000 1.000 CA 1.615 10 residues pruned to eliminate duplicates Z: 26 31.107 2.181 1.039 0.594 0.800 0.560 CB 1.598 26 residues pruned to eliminate duplicates Z: 15 6.841 1.605 0.559 0.424 0.643 0.214 CB 1.231 15 residues pruned to eliminate duplicates Z: 8 6.470 1.727 0.473 0.558 0.714 0.286 CB 1.271 8 residues pruned to eliminate duplicates Z: 47 42.668 2.196 0.746 0.652 0.935 0.739 CB 1.523 47 residues pruned to eliminate duplicates Z: 113 81.061 2.243 1.043 0.640 0.938 0.688 CB 1.565 113 residues pruned to eliminate duplicates Z: 35 45.011 2.344 1.008 0.606 0.853 0.706 CA 1.739 35 residues pruned to eliminate duplicates Z: 12 45.891 2.603 1.165 0.925 0.909 0.545 CB 1.895 12 residues pruned to eliminate duplicates Z: 13 11.506 1.780 0.642 0.363 0.917 0.500 CA 1.436 13 residues pruned to eliminate duplicates Z: 6 2.970 1.051 0.736 0.727 1.000 0.400 CB 0.593 Z: 38 31.274 2.179 0.603 0.497 0.973 0.676 CB 1.518 38 residues pruned to eliminate duplicates Z: 12 8.449 2.081 0.589 0.379 0.727 0.364 CB 1.205 12 residues pruned to eliminate duplicates Z: 49 66.582 2.512 1.012 0.593 0.979 0.604 CB 1.776 49 residues pruned to eliminate duplicates Z: 49 45.079 2.244 0.840 0.561 0.938 0.604 CB 1.585 49 residues pruned to eliminate duplicates Z: 6 3.394 1.513 0.569 0.439 0.600 0.400 CB 1.134 6 residues pruned to eliminate duplicates Z: 24 19.360 2.009 0.592 0.533 0.870 0.609 CB 1.405 24 residues pruned to eliminate duplicates Z: 31 22.910 2.202 0.696 0.413 0.800 0.467 CA 1.533 31 residues pruned to eliminate duplicates Z: 71 59.135 2.243 0.933 0.642 0.914 0.571 CB 1.562 71 residues pruned to eliminate duplicates Z: 8 14.452 1.899 0.558 0.812 1.000 0.571 CA 1.408 8 residues pruned to eliminate duplicates Z: 27 32.085 2.181 0.863 0.555 0.923 0.654 CA 1.590 27 residues pruned to eliminate duplicates Z: 10 10.067 1.667 0.490 0.831 1.000 0.889 CB 1.015 10 residues pruned to eliminate duplicates Z: 37 47.295 2.344 0.817 0.614 0.972 0.528 CB 1.708 37 residues pruned to eliminate duplicates Z: 21 22.136 2.144 0.760 0.543 0.950 0.600 CB 1.324 21 residues pruned to eliminate duplicates Z: 11 12.317 1.946 0.637 0.661 0.800 0.400 CB 1.317 11 residues pruned to eliminate duplicates Z: 15 19.818 1.742 0.633 0.882 1.000 0.786 CA 1.346 15 residues pruned to eliminate duplicates Z: 140 100.137 2.410 0.975 0.627 0.950 0.626 CB 1.667 140 residues pruned to eliminate duplicates Z: 118 92.395 2.318 1.086 0.618 0.957 0.607 CB 1.651 118 residues pruned to eliminate duplicates Z: 11 6.994 1.900 0.589 0.238 0.700 0.600 CA 1.418 11 residues pruned to eliminate duplicates Z: 14 16.926 1.911 0.546 0.719 0.923 0.462 CB 1.412 14 residues pruned to eliminate duplicates Z: 202 95.820 2.254 0.906 0.572 0.935 0.627 CB 1.569 202 residues pruned to eliminate duplicates Z: 19 19.425 2.002 0.714 0.520 0.889 0.556 CB 1.472 19 residues pruned to eliminate duplicates Z: 70 74.859 2.438 1.018 0.647 0.913 0.609 CB 1.749 70 residues pruned to eliminate duplicates Z: 7 7.109 1.442 0.378 0.748 1.000 0.500 C 1.170 7 residues pruned to eliminate duplicates Z: 26 26.417 2.107 1.081 0.560 0.920 0.560 CB 1.235 26 residues pruned to eliminate duplicates Z: 16 11.651 2.008 0.485 0.342 0.800 0.400 CB 1.497 16 residues pruned to eliminate duplicates Z: 56 48.980 2.169 0.914 0.642 0.927 0.473 CB 1.502 56 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 10 14.416 1.666 0.962 0.895 1.000 0.889 CB 1.053 9 residues pruned to eliminate duplicates Z: 8 14.886 1.867 0.605 0.918 1.000 1.000 CB 1.324 8 residues pruned to eliminate duplicates Z: 14 11.238 1.590 0.627 0.639 0.923 0.538 CB 1.146 10 residues pruned to eliminate duplicates Z: 10 13.241 1.809 0.649 0.914 1.000 0.889 CB 1.047 10 residues pruned to eliminate duplicates Z: 13 10.838 1.732 0.461 0.607 0.917 0.667 CB 1.218 12 residues pruned to eliminate duplicates Z: 10 12.643 1.789 0.689 0.891 1.000 0.778 CB 1.002 14 residues pruned to eliminate duplicates Z: 9 14.552 1.846 0.683 0.923 1.000 0.750 CB 1.163 10 residues pruned to eliminate duplicates Z: 9 12.939 1.846 0.655 0.925 1.000 1.000 CB 1.050 9 residues pruned to eliminate duplicates Z: 13 10.892 1.689 0.552 0.615 0.917 0.750 CB 1.174 13 residues pruned to eliminate duplicates Z: 13 10.385 1.685 0.436 0.611 0.917 0.667 CB 1.216 13 residues pruned to eliminate duplicates Z: 84 56.600 2.229 0.922 0.499 0.916 0.590 CB 1.586 92 residues pruned to eliminate duplicates Z: 7 8.950 2.008 0.843 0.591 0.667 0.167 CA 1.357 7 residues pruned to eliminate duplicates Z: 101 80.832 2.313 0.992 0.627 0.940 0.630 CB 1.657 101 residues pruned to eliminate duplicates Z: 76 57.496 2.285 0.900 0.535 0.893 0.533 CB 1.654 76 residues pruned to eliminate duplicates Z: 56 61.584 2.382 0.932 0.621 0.927 0.618 CB 1.736 56 residues pruned to eliminate duplicates Z: 64 59.732 2.318 1.031 0.574 0.905 0.524 CB 1.645 64 residues pruned to eliminate duplicates Z: 131 85.865 2.298 0.915 0.615 0.946 0.631 CB 1.621 131 residues pruned to eliminate duplicates Z: 57 70.352 2.393 1.089 0.610 0.982 0.589 CB 1.726 57 residues pruned to eliminate duplicates Z: 85 85.282 2.456 1.030 0.626 0.929 0.655 CB 1.785 85 residues pruned to eliminate duplicates Z: 59 62.531 2.389 0.977 0.594 0.931 0.603 CB 1.706 59 residues pruned to eliminate duplicates Z: 56 67.176 2.378 1.088 0.627 0.964 0.655 CB 1.680 56 residues pruned to eliminate duplicates Z: 94 82.118 2.395 0.985 0.636 0.914 0.602 CB 1.725 94 residues pruned to eliminate duplicates Z: 102 79.337 2.328 1.033 0.602 0.911 0.624 CB 1.661 102 residues pruned to eliminate duplicates Z: 103 76.995 2.318 0.996 0.587 0.922 0.598 CB 1.644 103 residues pruned to eliminate duplicates Z: 58 67.639 2.404 1.035 0.609 0.965 0.614 CB 1.712 58 residues pruned to eliminate duplicates Z: 60 64.911 2.366 1.054 0.594 0.915 0.661 CB 1.737 60 residues pruned to eliminate duplicates Z: 94 82.320 2.378 1.054 0.619 0.925 0.602 CB 1.690 94 residues pruned to eliminate duplicates Z: 78 61.611 2.257 1.018 0.537 0.922 0.610 CB 1.612 78 residues pruned to eliminate duplicates Z: 60 67.603 2.377 1.090 0.584 0.949 0.644 CB 1.723 60 residues pruned to eliminate duplicates Z: 59 59.348 2.366 0.947 0.583 0.931 0.621 CB 1.677 59 residues pruned to eliminate duplicates Z: 93 90.834 2.408 1.111 0.637 0.946 0.565 CB 1.732 128 residues pruned to eliminate duplicates Z: 6 3.569 1.456 0.647 0.408 0.800 0.200 C 0.916 6 residues pruned to eliminate duplicates Z: 57 55.848 2.206 0.978 0.700 0.929 0.625 CB 1.535 57 residues pruned to eliminate duplicates Z: 125 71.242 2.208 0.978 0.566 0.895 0.565 CB 1.535 125 residues pruned to eliminate duplicates Z: 79 58.234 2.171 0.931 0.603 0.923 0.564 CB 1.544 79 residues pruned to eliminate duplicates Z: 99 78.979 2.333 0.996 0.621 0.929 0.714 CB 1.646 99 residues pruned to eliminate duplicates Z: 45 40.184 2.177 0.983 0.626 0.841 0.545 CB 1.482 45 residues pruned to eliminate duplicates Z: 134 70.910 2.193 0.888 0.557 0.917 0.602 CB 1.531 134 residues pruned to eliminate duplicates Z: 39 52.936 2.313 1.097 0.681 0.895 0.632 CA 1.675 39 residues pruned to eliminate duplicates Z: 94 85.222 2.376 1.146 0.640 0.914 0.624 CB 1.664 94 residues pruned to eliminate duplicates Z: 40 52.582 2.334 1.081 0.675 0.897 0.641 CB 1.645 40 residues pruned to eliminate duplicates Z: 69 75.214 2.374 1.153 0.667 0.912 0.574 CB 1.677 69 residues pruned to eliminate duplicates Z: 48 50.024 2.205 1.059 0.630 0.936 0.511 CB 1.519 48 residues pruned to eliminate duplicates Z: 126 74.693 2.228 1.012 0.566 0.888 0.672 CB 1.575 100 residues pruned to eliminate duplicates Z: 9 16.817 1.903 1.072 0.817 0.875 0.250 CB 1.309 9 residues pruned to eliminate duplicates Z: 45 51.555 2.220 1.019 0.653 0.932 0.591 CB 1.614 45 residues pruned to eliminate duplicates Z: 72 70.306 2.254 1.102 0.657 0.930 0.648 CB 1.638 72 residues pruned to eliminate duplicates Z: 25 33.689 2.181 1.146 0.607 0.875 0.625 CB 1.516 25 residues pruned to eliminate duplicates Z: 93 89.234 2.397 1.142 0.640 0.924 0.587 CB 1.720 93 residues pruned to eliminate duplicates Z: 141 99.692 2.306 1.041 0.641 0.964 0.600 CB 1.627 141 residues pruned to eliminate duplicates Z: 72 46.694 2.107 0.776 0.587 0.958 0.634 CB 1.422 72 residues pruned to eliminate duplicates Z: 49 46.439 2.183 0.973 0.610 0.896 0.604 CB 1.565 49 residues pruned to eliminate duplicates Z: 46 48.217 2.213 0.976 0.612 0.933 0.578 CB 1.584 46 residues pruned to eliminate duplicates Z: 7 2.809 1.518 0.067 0.521 0.833 0.500 CB 0.832 7 residues pruned to eliminate duplicates Z: 80 65.038 2.214 0.972 0.612 0.962 0.582 CB 1.568 80 residues pruned to eliminate duplicates Z: 84 59.613 2.195 0.838 0.621 0.928 0.639 CB 1.560 84 residues pruned to eliminate duplicates Z: 113 79.088 2.260 0.966 0.622 0.946 0.634 CB 1.584 113 residues pruned to eliminate duplicates Z: 73 60.663 2.193 0.944 0.635 0.944 0.667 CA 1.565 73 residues pruned to eliminate duplicates Z: 10 4.638 1.513 0.101 0.687 1.000 0.778 CB 0.782 10 residues pruned to eliminate duplicates Z: 33 30.639 1.990 0.658 0.665 0.969 0.625 CB 1.455 33 residues pruned to eliminate duplicates Z: 142 86.995 2.272 0.979 0.623 0.922 0.688 CB 1.574 142 residues pruned to eliminate duplicates Z: 122 80.215 2.259 0.955 0.625 0.942 0.620 CB 1.557 122 residues pruned to eliminate duplicates Z: 158 87.637 2.243 0.944 0.596 0.924 0.662 CB 1.584 158 residues pruned to eliminate duplicates Z: 84 63.585 2.215 0.903 0.635 0.952 0.675 CB 1.534 84 residues pruned to eliminate duplicates Z: 142 93.976 2.287 1.017 0.637 0.950 0.617 CB 1.588 142 residues pruned to eliminate duplicates Z: 86 65.584 2.210 0.935 0.629 0.965 0.659 CB 1.528 86 residues pruned to eliminate duplicates Z: 107 84.691 2.256 1.090 0.644 0.962 0.670 CB 1.585 107 residues pruned to eliminate duplicates Z: 46 38.582 2.114 0.719 0.624 0.978 0.622 CB 1.440 46 residues pruned to eliminate duplicates Z: 65 44.897 2.122 0.757 0.582 0.906 0.531 CB 1.535 42 residues pruned to eliminate duplicates Z: 10 15.170 2.013 0.797 0.703 1.000 0.667 CA 1.161 10 residues pruned to eliminate duplicates Z: 88 69.336 2.216 1.017 0.634 0.943 0.575 CB 1.557 88 residues pruned to eliminate duplicates Z: 83 68.334 2.247 1.002 0.649 0.939 0.683 CB 1.555 83 residues pruned to eliminate duplicates Z: 35 40.787 2.116 0.952 0.644 1.000 0.706 CB 1.481 35 residues pruned to eliminate duplicates Z: 120 82.339 2.251 1.012 0.642 0.950 0.664 CB 1.537 120 residues pruned to eliminate duplicates Z: 135 89.331 2.256 0.988 0.642 0.948 0.597 CB 1.589 135 residues pruned to eliminate duplicates Z: 45 37.771 2.083 0.849 0.592 0.977 0.636 CB 1.386 45 residues pruned to eliminate duplicates Z: 45 41.739 2.141 0.807 0.637 1.000 0.659 CB 1.429 45 residues pruned to eliminate duplicates Z: 45 39.030 2.145 0.778 0.613 0.977 0.591 CB 1.418 45 residues pruned to eliminate duplicates Z: 108 75.003 2.242 0.984 0.631 0.944 0.626 CB 1.526 108 residues pruned to eliminate duplicates Z: 91 66.631 2.192 0.948 0.607 0.944 0.622 CB 1.573 91 residues pruned to eliminate duplicates Z: 83 64.432 2.219 0.856 0.631 0.976 0.707 CB 1.566 83 residues pruned to eliminate duplicates Z: 131 90.064 2.287 0.974 0.625 0.954 0.646 CB 1.631 131 residues pruned to eliminate duplicates Z: 152 95.325 2.278 1.095 0.600 0.927 0.636 CB 1.594 152 residues pruned to eliminate duplicates Z: 91 62.396 2.181 0.937 0.613 0.944 0.600 CB 1.481 91 residues pruned to eliminate duplicates Z: 48 46.428 2.254 1.088 0.504 0.894 0.617 CB 1.603 48 residues pruned to eliminate duplicates Z: 138 93.741 2.314 1.014 0.624 0.934 0.672 CB 1.636 138 residues pruned to eliminate duplicates Z: 86 68.304 2.229 0.940 0.628 0.965 0.600 CB 1.574 86 residues pruned to eliminate duplicates Z: 45 38.376 2.106 0.809 0.619 0.932 0.682 CB 1.456 45 residues pruned to eliminate duplicates Z: 17 19.208 2.093 0.873 0.499 1.000 0.500 CB 1.226 17 residues pruned to eliminate duplicates Z: 14 17.539 2.193 0.860 0.503 0.846 0.462 CB 1.404 14 residues pruned to eliminate duplicates Z: 114 79.425 2.249 0.991 0.630 0.947 0.602 CB 1.560 114 residues pruned to eliminate duplicates Z: 141 93.316 2.289 0.982 0.620 0.957 0.629 CB 1.621 141 residues pruned to eliminate duplicates Z: 16 17.815 2.031 0.877 0.455 0.933 0.600 CB 1.355 16 residues pruned to eliminate duplicates Z: 71 50.960 2.126 0.852 0.612 0.971 0.629 CB 1.432 71 residues pruned to eliminate duplicates Z: 86 61.752 2.219 0.843 0.618 0.953 0.624 CB 1.538 86 residues pruned to eliminate duplicates Z: 52 44.418 2.205 0.953 0.504 0.882 0.627 CB 1.630 52 residues pruned to eliminate duplicates Z: 32 43.467 2.306 1.190 0.590 0.839 0.581 CB 1.691 32 residues pruned to eliminate duplicates Z: 49 34.777 2.205 0.844 0.504 0.812 0.625 CB 1.513 49 residues pruned to eliminate duplicates Z: 70 68.463 2.345 1.090 0.608 0.884 0.652 CB 1.716 70 residues pruned to eliminate duplicates Z: 58 61.872 2.368 1.046 0.591 0.912 0.649 CB 1.699 58 residues pruned to eliminate duplicates Z: 101 79.769 2.320 1.013 0.617 0.920 0.540 CB 1.662 101 residues pruned to eliminate duplicates Z: 94 81.601 2.377 1.023 0.627 0.925 0.559 CB 1.687 94 residues pruned to eliminate duplicates Z: 59 67.614 2.372 1.082 0.604 0.948 0.603 CB 1.717 59 residues pruned to eliminate duplicates Z: 38 41.945 2.346 0.955 0.561 0.865 0.676 CB 1.638 38 residues pruned to eliminate duplicates Z: 31 50.795 2.308 1.304 0.588 0.933 0.633 CB 1.718 31 residues pruned to eliminate duplicates Z: 72 62.195 2.292 0.975 0.547 0.944 0.620 CB 1.650 72 residues pruned to eliminate duplicates Z: 34 42.616 2.318 1.034 0.546 0.879 0.545 CB 1.712 34 residues pruned to eliminate duplicates Z: 58 66.380 2.388 1.086 0.592 0.947 0.632 CB 1.705 58 residues pruned to eliminate duplicates Z: 58 66.626 2.390 1.112 0.596 0.947 0.526 CB 1.684 58 residues pruned to eliminate duplicates Z: 121 72.635 2.208 0.890 0.590 0.942 0.592 CB 1.549 121 residues pruned to eliminate duplicates Z: 88 85.458 2.418 1.036 0.599 0.954 0.575 CB 1.774 88 residues pruned to eliminate duplicates Z: 28 30.663 2.161 1.009 0.473 0.926 0.556 CB 1.509 28 residues pruned to eliminate duplicates Z: 60 60.857 2.364 1.075 0.566 0.932 0.593 CB 1.625 60 residues pruned to eliminate duplicates Z: 100 76.769 2.332 0.983 0.619 0.909 0.576 CB 1.641 100 residues pruned to eliminate duplicates Z: 97 80.678 2.350 1.087 0.610 0.906 0.604 CB 1.668 97 residues pruned to eliminate duplicates Z: 102 76.444 2.313 1.025 0.601 0.901 0.614 CB 1.637 102 residues pruned to eliminate duplicates Z: 58 68.082 2.385 1.063 0.599 0.982 0.579 CB 1.697 58 residues pruned to eliminate duplicates Z: 36 48.691 2.337 1.213 0.583 0.914 0.600 CB 1.607 36 residues pruned to eliminate duplicates Z: 95 83.495 2.377 1.045 0.625 0.936 0.585 CB 1.683 95 residues pruned to eliminate duplicates Z: 62 61.982 2.381 1.074 0.563 0.902 0.623 CB 1.677 62 residues pruned to eliminate duplicates Z: 58 61.833 2.389 0.992 0.594 0.930 0.579 CB 1.691 58 residues pruned to eliminate duplicates Z: 100 82.308 2.346 0.982 0.626 0.939 0.616 CB 1.682 100 residues pruned to eliminate duplicates Z: 87 76.676 2.415 0.980 0.606 0.895 0.581 CB 1.746 87 residues pruned to eliminate duplicates Z: 100 77.195 2.325 0.963 0.609 0.939 0.616 CB 1.632 100 residues pruned to eliminate duplicates Z: 101 79.391 2.324 1.030 0.603 0.930 0.530 CB 1.640 101 residues pruned to eliminate duplicates Z: 142 96.957 2.441 1.009 0.561 0.915 0.596 CB 1.716 142 residues pruned to eliminate duplicates Z: 102 80.928 2.344 1.050 0.592 0.921 0.653 CB 1.667 102 residues pruned to eliminate duplicates Z: 102 78.429 2.306 1.029 0.614 0.941 0.644 CB 1.592 102 residues pruned to eliminate duplicates Z: 94 87.197 2.386 1.044 0.643 0.946 0.570 CB 1.715 94 residues pruned to eliminate duplicates Z: 114 73.667 2.248 0.867 0.613 0.938 0.558 CB 1.582 114 residues pruned to eliminate duplicates Z: 100 83.376 2.339 1.094 0.619 0.929 0.566 CB 1.646 100 residues pruned to eliminate duplicates Z: 100 83.354 2.336 1.070 0.617 0.929 0.636 CB 1.669 100 residues pruned to eliminate duplicates Z: 22 35.200 2.448 1.034 0.580 0.810 0.476 CA 1.765 22 residues pruned to eliminate duplicates Z: 97 79.614 2.344 1.013 0.602 0.927 0.521 CB 1.685 97 residues pruned to eliminate duplicates Z: 93 89.319 2.397 1.138 0.649 0.935 0.533 CB 1.692 93 residues pruned to eliminate duplicates Z: 93 82.693 2.395 1.079 0.620 0.902 0.543 CB 1.713 93 residues pruned to eliminate duplicates Z: 21 30.308 2.280 1.030 0.588 0.850 0.550 CA 1.583 21 residues pruned to eliminate duplicates Z: 88 84.571 2.412 1.122 0.609 0.931 0.563 CB 1.716 88 residues pruned to eliminate duplicates Z: 100 80.681 2.341 1.058 0.638 0.899 0.646 CB 1.645 100 residues pruned to eliminate duplicates Z: 45 53.402 2.270 1.023 0.653 0.932 0.636 CB 1.631 45 residues pruned to eliminate duplicates Z: 130 80.325 2.221 1.025 0.562 0.930 0.519 CB 1.592 121 residues pruned to eliminate duplicates Z: 9 27.737 2.173 0.883 0.910 1.000 0.875 CB 1.699 9 residues pruned to eliminate duplicates Z: 10 21.428 1.959 0.837 0.911 1.000 0.556 CB 1.407 10 residues pruned to eliminate duplicates Z: 16 18.373 2.154 0.423 0.531 0.933 0.267 CB 1.607 16 residues pruned to eliminate duplicates Z: 16 19.207 2.106 0.545 0.539 0.933 0.467 CA 1.572 16 residues pruned to eliminate duplicates Z: 11 18.136 1.892 0.548 0.908 1.000 0.900 CB 1.391 11 residues pruned to eliminate duplicates Z: 16 20.256 2.138 0.675 0.463 0.933 0.533 CA 1.624 16 residues pruned to eliminate duplicates Z: 11 19.151 1.901 0.740 0.871 1.000 0.600 CB 1.336 11 residues pruned to eliminate duplicates Z: 17 14.650 2.070 0.525 0.438 0.812 0.562 CB 1.521 17 residues pruned to eliminate duplicates Z: 14 19.498 1.954 0.557 0.656 1.000 0.308 CB 1.538 14 residues pruned to eliminate duplicates Z: 17 18.088 2.095 0.495 0.446 0.938 0.438 CA 1.627 17 residues pruned to eliminate duplicates Z: 17 16.203 2.026 0.536 0.498 0.875 0.688 CB 1.491 17 residues pruned to eliminate duplicates Z: 19 14.433 1.958 0.524 0.384 0.889 0.500 CB 1.450 19 residues pruned to eliminate duplicates Z: 17 12.914 2.027 0.444 0.443 0.812 0.500 CB 1.440 17 residues pruned to eliminate duplicates Z: 8 5.237 1.585 0.208 0.627 1.000 0.714 CB 0.918 Z: 10 7.264 1.544 0.108 0.876 1.000 0.778 CB 1.029 18 residues pruned to eliminate duplicates Z: 10 7.280 1.596 0.196 0.677 1.000 0.778 CB 1.080 10 residues pruned to eliminate duplicates Z: 11 6.214 1.607 0.209 0.612 0.900 0.600 CB 1.010 11 residues pruned to eliminate duplicates Z: 10 7.772 1.614 0.137 0.766 1.000 0.667 CB 1.115 9 residues pruned to eliminate duplicates Z: 9 5.676 1.525 0.203 0.800 0.875 0.625 CB 0.962 9 residues pruned to eliminate duplicates Z: 15 5.358 1.413 0.191 0.446 0.929 0.643 CA 0.969 15 residues pruned to eliminate duplicates Z: 20 9.657 1.522 0.193 0.580 1.000 0.632 CB 1.129 20 residues pruned to eliminate duplicates Z: 12 7.112 1.425 0.158 0.753 1.000 0.727 CB 1.037 12 residues pruned to eliminate duplicates Z: 21 8.446 1.468 0.307 0.535 0.850 0.600 CB 1.119 21 residues pruned to eliminate duplicates Z: 19 9.169 1.532 0.469 0.486 0.944 0.444 CB 1.031 19 residues pruned to eliminate duplicates Z: 20 8.856 1.543 0.354 0.544 0.895 0.632 CB 1.041 10 residues pruned to eliminate duplicates 6 1.468 1.303 0.328 0.284 0.800 0.800 CA 0.605 ? Z: 8 2.230 1.143 0.226 0.481 0.714 0.571 CA 0.858 8 residues pruned to eliminate duplicates Z: 21 10.000 1.520 0.345 0.496 1.000 0.600 CB 1.098 22 residues pruned to eliminate duplicates Z: 12 19.445 2.004 0.433 0.891 1.000 0.727 CB 1.468 12 residues pruned to eliminate duplicates Z: 27 14.909 2.053 0.452 0.381 0.692 0.538 CB 1.608 27 residues pruned to eliminate duplicates Z: 87 51.307 2.299 0.730 0.466 0.872 0.512 CB 1.650 87 residues pruned to eliminate duplicates Z: 102 67.482 2.285 0.894 0.581 0.901 0.673 CB 1.592 102 residues pruned to eliminate duplicates Z: 18 21.080 2.256 0.476 0.454 0.941 0.529 CB 1.710 18 residues pruned to eliminate duplicates Z: 28 19.589 2.165 0.552 0.427 0.778 0.481 CB 1.556 28 residues pruned to eliminate duplicates Z: 19 19.253 2.190 0.511 0.385 0.889 0.500 CB 1.742 19 residues pruned to eliminate duplicates Z: 19 22.606 2.234 0.590 0.472 0.944 0.611 CB 1.633 19 residues pruned to eliminate duplicates Z: 16 24.885 2.288 0.866 0.459 0.933 0.600 CA 1.681 16 residues pruned to eliminate duplicates Z: 21 21.648 2.109 0.777 0.415 0.950 0.500 CA 1.486 21 residues pruned to eliminate duplicates Z: 19 20.183 2.174 0.740 0.394 0.833 0.444 CA 1.688 19 residues pruned to eliminate duplicates Z: 20 20.704 2.146 0.628 0.455 0.895 0.316 CA 1.592 20 residues pruned to eliminate duplicates Z: 18 17.816 2.220 0.639 0.453 0.765 0.471 CB 1.629 18 residues pruned to eliminate duplicates Z: 18 20.766 2.199 0.611 0.458 0.882 0.471 CA 1.682 18 residues pruned to eliminate duplicates Z: 41 24.424 2.208 0.543 0.375 0.900 0.450 CB 1.440 41 residues pruned to eliminate duplicates Z: 143 75.503 2.339 0.781 0.510 0.923 0.613 CB 1.633 143 residues pruned to eliminate duplicates Z: 32 19.534 2.248 0.352 0.388 0.839 0.452 CB 1.550 32 residues pruned to eliminate duplicates Z: 11 6.268 2.197 0.125 0.154 0.800 0.200 CB 1.534 11 residues pruned to eliminate duplicates Z: 35 24.932 2.246 0.566 0.441 0.824 0.559 CB 1.569 35 residues pruned to eliminate duplicates Z: 11 13.060 2.202 0.472 0.423 0.900 0.500 CB 1.534 11 residues pruned to eliminate duplicates Z: 212 98.172 2.357 0.843 0.559 0.905 0.626 CB 1.624 212 residues pruned to eliminate duplicates Z: 22 17.013 2.170 0.533 0.469 0.857 0.476 CB 1.344 22 residues pruned to eliminate duplicates Z: 136 69.491 2.350 0.805 0.504 0.881 0.622 CB 1.594 136 residues pruned to eliminate duplicates Z: 85 55.433 2.317 0.858 0.500 0.905 0.607 CB 1.553 85 residues pruned to eliminate duplicates Z: 24 20.118 2.237 0.649 0.437 0.783 0.609 CB 1.550 24 residues pruned to eliminate duplicates Z: 24 21.924 2.259 0.541 0.487 0.913 0.435 CB 1.457 24 residues pruned to eliminate duplicates Z: 20 21.350 2.288 0.678 0.540 0.842 0.316 CB 1.458 20 residues pruned to eliminate duplicates Z: 23 15.375 2.115 0.703 0.315 0.818 0.455 CB 1.365 23 residues pruned to eliminate duplicates Z: 8 9.100 2.059 0.714 0.612 0.571 0.429 CB 1.534 8 residues pruned to eliminate duplicates Z: 33 22.719 2.280 0.586 0.392 0.812 0.500 CB 1.532 33 residues pruned to eliminate duplicates Z: 20 22.434 2.366 0.539 0.476 0.842 0.526 CB 1.719 20 residues pruned to eliminate duplicates Z: 143 81.154 2.319 0.901 0.564 0.915 0.683 CB 1.587 143 residues pruned to eliminate duplicates Z: 20 22.405 2.325 0.608 0.429 0.842 0.526 CB 1.757 20 residues pruned to eliminate duplicates Z: 22 18.020 2.244 0.595 0.430 0.762 0.571 CB 1.550 22 residues pruned to eliminate duplicates Z: 35 26.252 2.162 0.698 0.409 0.941 0.559 CB 1.433 35 residues pruned to eliminate duplicates Z: 28 14.906 1.803 0.673 0.324 0.852 0.444 CB 1.354 28 residues pruned to eliminate duplicates Z: 215 96.920 2.340 0.905 0.547 0.879 0.593 CB 1.616 215 residues pruned to eliminate duplicates Z: 78 47.436 2.298 0.835 0.443 0.857 0.584 CB 1.585 78 residues pruned to eliminate duplicates Z: 17 18.871 2.188 0.508 0.480 0.938 0.750 CA 1.557 17 residues pruned to eliminate duplicates Z: 92 50.360 2.283 0.693 0.498 0.879 0.604 CB 1.556 92 residues pruned to eliminate duplicates Z: 199 102.111 2.367 0.908 0.562 0.909 0.641 CB 1.663 199 residues pruned to eliminate duplicates Z: 191 95.787 2.380 0.854 0.562 0.884 0.605 CB 1.677 191 residues pruned to eliminate duplicates Z: 119 73.257 2.390 0.898 0.527 0.873 0.644 CB 1.658 119 residues pruned to eliminate duplicates Z: 64 43.723 2.307 0.806 0.472 0.873 0.619 CB 1.557 64 residues pruned to eliminate duplicates Z: 199 106.694 2.355 0.922 0.564 0.949 0.621 CB 1.658 199 residues pruned to eliminate duplicates Z: 70 41.881 2.238 0.889 0.469 0.841 0.623 CB 1.464 70 residues pruned to eliminate duplicates Z: 150 88.364 2.421 0.881 0.550 0.893 0.671 CB 1.697 150 residues pruned to eliminate duplicates Z: 131 82.428 2.393 0.946 0.546 0.885 0.615 CB 1.678 131 residues pruned to eliminate duplicates Z: 95 56.098 2.323 0.777 0.470 0.915 0.511 CB 1.579 95 residues pruned to eliminate duplicates Z: 85 57.565 2.365 0.828 0.510 0.893 0.607 CB 1.612 85 residues pruned to eliminate duplicates Z: 76 49.561 2.285 0.841 0.475 0.880 0.573 CB 1.585 76 residues pruned to eliminate duplicates Z: 48 40.174 2.278 0.805 0.508 0.915 0.723 CB 1.545 48 residues pruned to eliminate duplicates Z: 177 101.065 2.358 0.917 0.593 0.920 0.636 CB 1.676 177 residues pruned to eliminate duplicates Z: 166 94.120 2.396 0.926 0.560 0.909 0.642 CB 1.648 178 residues pruned to eliminate duplicates Z: 16 29.791 2.121 1.112 0.925 0.933 0.667 CB 1.291 16 residues pruned to eliminate duplicates Z: 195 106.060 2.384 0.956 0.570 0.912 0.572 CB 1.673 195 residues pruned to eliminate duplicates Z: 221 105.510 2.352 0.940 0.539 0.909 0.582 CB 1.650 207 residues pruned to eliminate duplicates Z: 16 30.199 2.256 1.172 0.860 0.933 0.733 CB 1.254 16 residues pruned to eliminate duplicates Z: 68 43.436 2.224 0.821 0.453 0.881 0.627 CB 1.561 68 residues pruned to eliminate duplicates Z: 39 43.733 2.283 1.018 0.599 0.947 0.711 CB 1.478 39 residues pruned to eliminate duplicates Z: 60 41.295 2.225 0.876 0.442 0.881 0.508 CB 1.551 60 residues pruned to eliminate duplicates Z: 149 96.733 2.416 0.967 0.567 0.926 0.615 CB 1.694 149 residues pruned to eliminate duplicates Z: 68 45.134 2.215 0.903 0.465 0.866 0.642 CB 1.565 68 residues pruned to eliminate duplicates Z: 214 101.015 2.337 0.916 0.544 0.915 0.629 CB 1.618 214 residues pruned to eliminate duplicates Z: 168 97.851 2.388 0.905 0.576 0.922 0.641 CB 1.678 168 residues pruned to eliminate duplicates Z: 131 70.140 2.347 0.859 0.502 0.885 0.546 CB 1.590 131 residues pruned to eliminate duplicates Z: 68 49.296 2.258 0.947 0.485 0.910 0.567 CB 1.527 68 residues pruned to eliminate duplicates Z: 77 53.942 2.299 0.834 0.494 0.921 0.632 CB 1.602 77 residues pruned to eliminate duplicates Z: 152 94.013 2.405 0.939 0.560 0.927 0.642 CB 1.670 152 residues pruned to eliminate duplicates Z: 148 94.894 2.409 0.950 0.578 0.918 0.633 CB 1.683 148 residues pruned to eliminate duplicates Z: 78 59.017 2.373 0.861 0.523 0.909 0.623 CB 1.637 78 residues pruned to eliminate duplicates Z: 52 43.891 2.366 0.820 0.463 0.902 0.529 CB 1.644 52 residues pruned to eliminate duplicates Z: 60 48.149 2.294 0.890 0.474 0.949 0.610 CB 1.564 60 residues pruned to eliminate duplicates Z: 65 45.916 2.247 0.821 0.473 0.922 0.609 CB 1.564 65 residues pruned to eliminate duplicates Z: 127 91.035 2.448 1.018 0.567 0.905 0.651 CB 1.702 127 residues pruned to eliminate duplicates Z: 30 29.520 2.300 0.884 0.338 0.931 0.586 CA 1.621 30 residues pruned to eliminate duplicates Z: 50 47.405 2.413 0.790 0.482 0.918 0.612 CB 1.739 50 residues pruned to eliminate duplicates Z: 32 28.993 2.271 0.837 0.332 0.903 0.516 CA 1.661 32 residues pruned to eliminate duplicates Z: 98 54.723 2.302 0.772 0.490 0.907 0.608 CB 1.516 98 residues pruned to eliminate duplicates Z: 33 28.719 2.209 0.638 0.496 0.875 0.625 CB 1.610 33 residues pruned to eliminate duplicates Z: 91 74.037 2.446 1.015 0.533 0.889 0.633 CB 1.724 91 residues pruned to eliminate duplicates Z: 113 72.548 2.346 0.917 0.528 0.920 0.625 CB 1.612 113 residues pruned to eliminate duplicates Z: 154 89.727 2.400 0.909 0.568 0.889 0.569 CB 1.667 154 residues pruned to eliminate duplicates Z: 147 92.117 2.407 0.976 0.552 0.911 0.610 CB 1.673 147 residues pruned to eliminate duplicates Z: 196 98.996 2.366 0.905 0.574 0.908 0.646 CB 1.613 196 residues pruned to eliminate duplicates Z: 16 10.306 1.913 0.919 0.282 0.867 0.200 CB 1.070 16 residues pruned to eliminate duplicates Z: 23 34.081 2.449 0.750 0.580 0.909 0.682 CA 1.727 23 residues pruned to eliminate duplicates Z: 90 89.836 2.487 1.031 0.602 0.955 0.596 CB 1.791 90 residues pruned to eliminate duplicates Z: 68 60.237 2.412 0.894 0.549 0.925 0.522 CB 1.658 68 residues pruned to eliminate duplicates Z: 89 81.270 2.464 0.944 0.584 0.932 0.625 CB 1.789 89 residues pruned to eliminate duplicates Z: 170 95.330 2.372 0.866 0.568 0.929 0.627 CB 1.670 170 residues pruned to eliminate duplicates Z: 169 99.451 2.390 0.966 0.564 0.911 0.631 CB 1.685 169 residues pruned to eliminate duplicates Z: 128 87.016 2.392 0.877 0.623 0.898 0.630 CB 1.707 128 residues pruned to eliminate duplicates Z: 61 63.547 2.462 0.952 0.573 0.933 0.567 CB 1.705 61 residues pruned to eliminate duplicates Z: 167 96.920 2.395 0.927 0.570 0.928 0.657 CB 1.642 167 residues pruned to eliminate duplicates Z: 31 28.423 2.242 0.720 0.555 0.833 0.533 CB 1.530 31 residues pruned to eliminate duplicates Z: 89 84.162 2.471 0.947 0.600 0.943 0.648 CB 1.798 89 residues pruned to eliminate duplicates Z: 25 28.579 2.372 0.728 0.540 0.875 0.500 CB 1.564 25 residues pruned to eliminate duplicates Z: 23 29.972 2.413 0.714 0.562 0.864 0.364 CB 1.684 23 residues pruned to eliminate duplicates Z: 83 84.800 2.509 1.058 0.586 0.939 0.573 CB 1.778 83 residues pruned to eliminate duplicates Z: 96 65.100 2.410 0.946 0.517 0.842 0.558 CB 1.663 96 residues pruned to eliminate duplicates Z: 148 95.011 2.416 0.958 0.562 0.925 0.585 CB 1.685 148 residues pruned to eliminate duplicates Z: 87 52.767 2.289 0.871 0.490 0.872 0.558 CB 1.539 87 residues pruned to eliminate duplicates Z: 61 57.119 2.418 0.955 0.567 0.917 0.550 CB 1.595 61 residues pruned to eliminate duplicates Z: 156 95.328 2.381 0.915 0.578 0.935 0.574 CB 1.665 156 residues pruned to eliminate duplicates Z: 83 76.612 2.355 0.997 0.635 0.951 0.646 CB 1.666 83 residues pruned to eliminate duplicates Z: 59 50.498 2.223 0.910 0.599 0.914 0.621 CB 1.556 59 residues pruned to eliminate duplicates Z: 202 118.534 2.383 1.016 0.596 0.935 0.657 CB 1.697 329 residues pruned to eliminate duplicates Z: 12 17.344 1.961 0.772 0.628 1.000 0.818 CA 1.334 12 residues pruned to eliminate duplicates Z: 65 56.734 2.250 0.917 0.615 0.938 0.641 CB 1.572 48 residues pruned to eliminate duplicates Z: 16 34.459 2.167 1.137 0.801 0.933 0.800 CB 1.583 16 residues pruned to eliminate duplicates Z: 60 50.479 2.208 0.838 0.630 0.932 0.593 CB 1.537 60 residues pruned to eliminate duplicates Z: 116 83.600 2.353 0.954 0.611 0.922 0.643 CB 1.656 112 residues pruned to eliminate duplicates Z: 16 36.584 2.183 1.080 0.919 1.000 0.733 CA 1.466 16 residues pruned to eliminate duplicates Z: 74 64.710 2.316 0.975 0.569 0.945 0.603 CB 1.639 74 residues pruned to eliminate duplicates Z: 85 67.687 2.277 1.001 0.636 0.929 0.619 CB 1.536 85 residues pruned to eliminate duplicates Z: 57 52.171 2.234 0.862 0.629 0.964 0.679 CB 1.540 57 residues pruned to eliminate duplicates Z: 82 74.854 2.358 0.923 0.657 0.963 0.679 CB 1.646 82 residues pruned to eliminate duplicates Z: 112 90.758 2.374 1.078 0.631 0.937 0.658 CB 1.647 112 residues pruned to eliminate duplicates Z: 87 71.429 2.325 1.010 0.622 0.930 0.605 CB 1.579 87 residues pruned to eliminate duplicates Z: 86 74.736 2.373 0.991 0.618 0.906 0.671 CB 1.694 86 residues pruned to eliminate duplicates Z: 84 74.214 2.331 0.976 0.662 0.964 0.675 CB 1.579 84 residues pruned to eliminate duplicates Z: 85 74.750 2.331 0.970 0.626 0.964 0.595 CB 1.635 85 residues pruned to eliminate duplicates Z: 83 75.462 2.330 0.963 0.644 0.951 0.634 CB 1.675 83 residues pruned to eliminate duplicates Z: 82 72.175 2.358 0.977 0.618 0.951 0.654 CB 1.619 82 residues pruned to eliminate duplicates Z: 69 63.120 2.298 0.919 0.624 0.971 0.676 CB 1.591 69 residues pruned to eliminate duplicates Z: 85 73.346 2.335 0.890 0.641 0.964 0.583 CB 1.648 85 residues pruned to eliminate duplicates Z: 81 83.916 2.366 1.070 0.677 0.963 0.650 CB 1.691 81 residues pruned to eliminate duplicates Z: 68 64.673 2.290 1.079 0.627 0.910 0.522 CB 1.618 68 residues pruned to eliminate duplicates Z: 86 72.840 2.326 0.914 0.643 0.953 0.612 CB 1.629 86 residues pruned to eliminate duplicates Z: 60 54.042 2.216 0.893 0.635 0.949 0.661 CB 1.557 60 residues pruned to eliminate duplicates Z: 88 67.000 2.322 0.823 0.619 0.943 0.563 CB 1.609 88 residues pruned to eliminate duplicates Z: 43 48.450 2.201 0.839 0.690 0.976 0.690 CA 1.590 43 residues pruned to eliminate duplicates Z: 31 43.219 2.325 1.002 0.575 0.967 0.667 CB 1.632 31 residues pruned to eliminate duplicates Z: 60 53.164 2.224 0.882 0.607 0.949 0.644 CB 1.574 60 residues pruned to eliminate duplicates Z: 82 76.230 2.359 0.942 0.632 0.975 0.593 CB 1.674 82 residues pruned to eliminate duplicates Z: 83 73.595 2.357 0.889 0.644 0.951 0.561 CB 1.678 83 residues pruned to eliminate duplicates Z: 81 76.909 2.356 0.956 0.670 0.975 0.637 CB 1.636 81 residues pruned to eliminate duplicates Z: 86 66.386 2.265 1.010 0.564 0.929 0.565 CB 1.599 86 residues pruned to eliminate duplicates Z: 85 73.795 2.319 0.966 0.635 0.964 0.667 CB 1.613 85 residues pruned to eliminate duplicates Z: 31 45.305 2.326 1.114 0.574 0.933 0.667 CB 1.678 31 residues pruned to eliminate duplicates Z: 56 55.902 2.278 0.973 0.676 0.909 0.691 CB 1.569 56 residues pruned to eliminate duplicates Z: 163 86.330 2.314 0.913 0.557 0.914 0.586 CB 1.587 163 residues pruned to eliminate duplicates Z: 108 86.861 2.385 1.075 0.631 0.925 0.636 CB 1.622 108 residues pruned to eliminate duplicates Z: 90 71.654 2.309 0.957 0.633 0.921 0.652 CB 1.611 90 residues pruned to eliminate duplicates Z: 109 86.440 2.364 1.011 0.626 0.963 0.556 CB 1.613 70 residues pruned to eliminate duplicates Z: 6 8.649 1.875 0.725 0.440 0.800 0.800 C 1.590 Z: 8 5.494 1.568 0.689 0.536 0.714 0.571 CA 1.060 8 residues pruned to eliminate duplicates Z: 74 70.281 2.430 0.960 0.590 0.904 0.685 CB 1.753 74 residues pruned to eliminate duplicates Z: 76 70.843 2.416 1.054 0.576 0.907 0.640 CB 1.690 76 residues pruned to eliminate duplicates Z: 123 81.986 2.357 0.956 0.578 0.910 0.582 CB 1.641 123 residues pruned to eliminate duplicates Z: 49 47.207 2.333 0.984 0.526 0.896 0.646 CB 1.602 49 residues pruned to eliminate duplicates Z: 136 88.747 2.365 0.832 0.616 0.941 0.615 CB 1.679 136 residues pruned to eliminate duplicates Z: 88 79.762 2.463 0.989 0.583 0.931 0.609 CB 1.732 88 residues pruned to eliminate duplicates Z: 146 95.906 2.398 0.948 0.596 0.903 0.628 CB 1.722 146 residues pruned to eliminate duplicates Z: 84 62.328 2.407 0.862 0.497 0.916 0.578 CB 1.672 84 residues pruned to eliminate duplicates Z: 139 97.112 2.383 0.931 0.626 0.949 0.616 CB 1.681 139 residues pruned to eliminate duplicates Z: 90 83.177 2.454 1.052 0.599 0.933 0.652 CB 1.709 90 residues pruned to eliminate duplicates Z: 59 64.127 2.424 1.023 0.595 0.948 0.552 CB 1.654 59 residues pruned to eliminate duplicates Z: 122 75.670 2.364 0.907 0.540 0.926 0.603 CB 1.585 122 residues pruned to eliminate duplicates Z: 111 83.823 2.369 0.968 0.630 0.918 0.609 CB 1.653 111 residues pruned to eliminate duplicates Z: 142 87.631 2.350 0.930 0.583 0.929 0.560 CB 1.617 145 residues pruned to eliminate duplicates Z: 7 9.702 1.957 0.534 0.478 1.000 0.833 CA 1.349 7 residues pruned to eliminate duplicates Z: 63 51.338 2.416 0.822 0.524 0.887 0.565 CB 1.631 63 residues pruned to eliminate duplicates Z: 26 37.264 2.383 1.187 0.553 0.920 0.680 CB 1.477 26 residues pruned to eliminate duplicates Z: 61 63.598 2.423 1.010 0.583 0.917 0.667 CB 1.698 61 residues pruned to eliminate duplicates Z: 62 56.555 2.427 0.900 0.569 0.902 0.689 CB 1.629 62 residues pruned to eliminate duplicates Z: 28 34.426 2.278 1.083 0.537 0.926 0.556 CB 1.454 28 residues pruned to eliminate duplicates Z: 61 60.613 2.459 0.937 0.560 0.917 0.550 CB 1.691 61 residues pruned to eliminate duplicates Z: 60 57.460 2.452 0.899 0.530 0.932 0.576 CB 1.673 60 residues pruned to eliminate duplicates Z: 109 84.119 2.368 0.975 0.642 0.917 0.648 CB 1.653 109 residues pruned to eliminate duplicates Z: 26 38.795 2.402 1.194 0.560 0.920 0.640 CB 1.510 26 residues pruned to eliminate duplicates Z: 109 88.426 2.375 1.028 0.645 0.926 0.713 CB 1.666 109 residues pruned to eliminate duplicates Z: 115 87.864 2.364 1.000 0.609 0.939 0.632 CB 1.672 115 residues pruned to eliminate duplicates Z: 173 103.862 2.374 0.936 0.592 0.942 0.634 CB 1.675 173 residues pruned to eliminate duplicates Z: 115 90.855 2.371 1.027 0.615 0.939 0.649 CB 1.691 115 residues pruned to eliminate duplicates Z: 18 43.958 2.300 1.293 0.836 1.000 0.588 CB 1.514 18 residues pruned to eliminate duplicates Z: 60 64.355 2.482 0.973 0.566 0.932 0.576 CB 1.722 60 residues pruned to eliminate duplicates Z: 121 80.807 2.315 0.967 0.591 0.933 0.642 CB 1.591 121 residues pruned to eliminate duplicates Z: 145 84.298 2.367 0.944 0.527 0.924 0.604 CB 1.609 145 residues pruned to eliminate duplicates Z: 113 84.518 2.349 1.022 0.627 0.920 0.580 CB 1.623 113 residues pruned to eliminate duplicates Z: 60 63.906 2.476 1.087 0.578 0.898 0.542 CB 1.663 60 residues pruned to eliminate duplicates Z: 219 104.948 2.343 0.945 0.557 0.904 0.615 CB 1.634 219 residues pruned to eliminate duplicates Z: 110 88.062 2.382 1.037 0.635 0.917 0.578 CB 1.669 110 residues pruned to eliminate duplicates Z: 62 53.963 2.375 0.997 0.541 0.885 0.459 CB 1.580 62 residues pruned to eliminate duplicates Z: 65 74.662 2.455 1.111 0.605 0.906 0.578 CB 1.797 65 residues pruned to eliminate duplicates Z: 143 93.155 2.373 0.949 0.608 0.930 0.577 CB 1.641 143 residues pruned to eliminate duplicates Z: 110 89.515 2.368 1.111 0.626 0.927 0.633 CB 1.644 110 residues pruned to eliminate duplicates Z: 82 69.977 2.350 0.910 0.644 0.914 0.679 CB 1.657 82 residues pruned to eliminate duplicates Z: 83 74.471 2.349 0.939 0.663 0.951 0.671 CB 1.632 83 residues pruned to eliminate duplicates Z: 83 79.451 2.350 0.972 0.670 0.963 0.671 CB 1.680 83 residues pruned to eliminate duplicates Z: 66 64.565 2.339 0.876 0.683 0.923 0.631 CB 1.671 66 residues pruned to eliminate duplicates Z: 82 73.645 2.312 0.988 0.640 0.963 0.630 CB 1.623 82 residues pruned to eliminate duplicates Z: 31 54.702 2.476 1.136 0.666 0.933 0.600 CA 1.736 31 residues pruned to eliminate duplicates Z: 89 69.372 2.298 0.911 0.629 0.932 0.602 CB 1.601 89 residues pruned to eliminate duplicates Z: 82 76.521 2.360 0.966 0.660 0.951 0.679 CB 1.663 82 residues pruned to eliminate duplicates Z: 28 46.050 2.485 1.136 0.591 0.889 0.556 CB 1.721 28 residues pruned to eliminate duplicates Z: 33 46.348 2.402 1.000 0.598 0.906 0.562 CB 1.714 33 residues pruned to eliminate duplicates Z: 27 52.052 2.494 1.040 0.683 0.962 0.577 CB 1.764 27 residues pruned to eliminate duplicates Z: 84 79.003 2.360 1.068 0.666 0.928 0.602 CB 1.642 84 residues pruned to eliminate duplicates Z: 33 44.411 2.444 0.998 0.585 0.875 0.406 CB 1.693 33 residues pruned to eliminate duplicates Z: 26 52.663 2.536 1.111 0.631 0.960 0.640 CB 1.812 26 residues pruned to eliminate duplicates Z: 82 74.780 2.339 1.012 0.642 0.951 0.605 CB 1.626 86 residues pruned to eliminate duplicates Z: 6 7.671 2.127 0.833 0.100 0.800 0.600 C 1.833 6 residues pruned to eliminate duplicates Z: 26 35.859 2.363 1.187 0.560 0.880 0.440 CB 1.487 26 residues pruned to eliminate duplicates Z: 33 50.739 2.455 1.071 0.619 0.906 0.656 CA 1.739 33 residues pruned to eliminate duplicates Z: 81 79.235 2.370 1.018 0.654 0.950 0.538 CB 1.688 81 residues pruned to eliminate duplicates Z: 85 70.304 2.297 0.945 0.654 0.940 0.583 CB 1.581 85 residues pruned to eliminate duplicates Z: 84 76.273 2.363 0.967 0.644 0.964 0.614 CB 1.634 84 residues pruned to eliminate duplicates Z: 17 29.262 2.292 1.191 0.490 0.875 0.562 CB 1.682 17 residues pruned to eliminate duplicates Z: 31 31.256 2.087 0.930 0.502 0.867 0.500 CA 1.630 31 residues pruned to eliminate duplicates Z: 72 57.113 2.220 0.868 0.592 0.930 0.563 CB 1.610 72 residues pruned to eliminate duplicates Z: 82 80.202 2.360 1.024 0.666 0.951 0.617 CB 1.684 82 residues pruned to eliminate duplicates Z: 83 76.025 2.347 1.047 0.642 0.927 0.610 CB 1.651 83 residues pruned to eliminate duplicates Z: 138 99.388 2.402 0.996 0.629 0.949 0.613 CB 1.653 138 residues pruned to eliminate duplicates Z: 113 88.199 2.356 1.110 0.621 0.938 0.696 CB 1.596 113 residues pruned to eliminate duplicates Z: 84 73.791 2.353 0.984 0.653 0.928 0.627 CB 1.622 84 residues pruned to eliminate duplicates Z: 29 11.811 1.964 0.469 0.318 0.714 0.393 CB 1.325 29 residues pruned to eliminate duplicates Z: 14 16.321 2.020 0.586 0.687 0.846 0.538 CA 1.406 14 residues pruned to eliminate duplicates Z: 11 21.646 2.141 0.537 0.783 1.000 0.600 CB 1.622 11 residues pruned to eliminate duplicates Z: 17 19.309 2.020 0.590 0.505 0.938 0.438 CB 1.596 17 residues pruned to eliminate duplicates Z: 21 14.800 2.070 0.373 0.377 0.900 0.300 CB 1.476 21 residues pruned to eliminate duplicates Z: 11 14.533 2.135 0.671 0.825 0.800 0.600 CB 1.216 11 residues pruned to eliminate duplicates Z: 17 17.523 2.011 0.526 0.445 1.000 0.500 CB 1.511 17 residues pruned to eliminate duplicates Z: 23 14.600 1.901 0.532 0.376 0.864 0.455 CB 1.414 23 residues pruned to eliminate duplicates Z: 175 79.055 2.260 0.798 0.510 0.902 0.563 CB 1.618 175 residues pruned to eliminate duplicates Z: 12 14.388 2.066 0.584 0.831 0.818 0.545 CB 1.217 12 residues pruned to eliminate duplicates Z: 17 19.942 2.094 0.676 0.478 0.875 0.500 CA 1.660 17 residues pruned to eliminate duplicates Z: 21 14.802 2.045 0.382 0.350 0.900 0.350 CB 1.529 21 residues pruned to eliminate duplicates Z: 20 14.207 1.976 0.608 0.352 0.895 0.421 CB 1.345 20 residues pruned to eliminate duplicates Z: 19 15.252 2.025 0.712 0.378 0.778 0.500 CA 1.518 19 residues pruned to eliminate duplicates Z: 24 22.050 2.112 0.689 0.432 0.870 0.391 CB 1.590 24 residues pruned to eliminate duplicates Z: 9 4.072 1.700 0.349 0.306 0.625 0.125 CB 1.246 9 residues pruned to eliminate duplicates Z: 152 87.730 2.273 0.993 0.603 0.907 0.623 CB 1.575 152 residues pruned to eliminate duplicates Z: 37 28.461 2.158 0.742 0.487 0.861 0.583 CB 1.485 38 residues pruned to eliminate duplicates Z: 7 5.048 1.798 0.203 0.527 1.000 0.833 CA 0.928 7 residues pruned to eliminate duplicates Z: 91 54.546 2.242 0.839 0.480 0.900 0.600 CB 1.582 91 residues pruned to eliminate duplicates Z: 23 18.298 2.079 0.726 0.461 0.864 0.545 CB 1.310 23 residues pruned to eliminate duplicates Z: 35 27.878 2.225 0.755 0.484 0.824 0.588 CB 1.511 35 residues pruned to eliminate duplicates Z: 35 25.731 2.176 0.624 0.510 0.853 0.588 CB 1.449 35 residues pruned to eliminate duplicates Z: 149 72.611 2.268 0.833 0.540 0.865 0.622 CB 1.596 149 residues pruned to eliminate duplicates Z: 19 17.716 2.164 0.695 0.465 0.889 0.611 CB 1.327 19 residues pruned to eliminate duplicates Z: 23 21.311 2.163 0.682 0.486 0.909 0.636 CB 1.393 23 residues pruned to eliminate duplicates Z: 16 14.239 2.056 0.683 0.495 0.800 0.533 CB 1.334 16 residues pruned to eliminate duplicates Z: 79 40.261 2.077 0.641 0.487 0.885 0.577 CB 1.532 79 residues pruned to eliminate duplicates Z: 66 37.857 2.129 0.676 0.513 0.862 0.662 CB 1.507 66 residues pruned to eliminate duplicates Z: 38 21.103 2.106 0.533 0.365 0.838 0.568 CB 1.482 38 residues pruned to eliminate duplicates Z: 36 22.706 2.068 0.671 0.386 0.914 0.600 CB 1.370 36 residues pruned to eliminate duplicates Z: 88 43.384 2.090 0.664 0.483 0.897 0.655 CB 1.516 88 residues pruned to eliminate duplicates Z: 33 24.966 2.117 0.685 0.435 0.875 0.531 CB 1.512 33 residues pruned to eliminate duplicates Z: 223 93.539 2.244 0.853 0.544 0.914 0.581 CB 1.582 223 residues pruned to eliminate duplicates Z: 47 33.065 2.182 0.707 0.472 0.891 0.543 CB 1.511 47 residues pruned to eliminate duplicates Z: 57 37.561 2.099 0.670 0.530 0.911 0.643 CB 1.527 57 residues pruned to eliminate duplicates Z: 61 38.258 2.129 0.702 0.526 0.900 0.650 CB 1.476 61 residues pruned to eliminate duplicates Z: 76 43.707 2.137 0.700 0.468 0.907 0.587 CB 1.583 76 residues pruned to eliminate duplicates Z: 220 92.509 2.252 0.814 0.553 0.913 0.607 CB 1.592 220 residues pruned to eliminate duplicates Z: 40 19.279 1.968 0.598 0.376 0.821 0.564 CB 1.366 40 residues pruned to eliminate duplicates Z: 196 87.394 2.238 0.851 0.550 0.903 0.610 CB 1.595 196 residues pruned to eliminate duplicates Z: 117 68.753 2.212 0.826 0.556 0.957 0.681 CB 1.564 117 residues pruned to eliminate duplicates Z: 229 97.167 2.268 0.831 0.568 0.912 0.640 CB 1.591 229 residues pruned to eliminate duplicates Z: 50 36.771 2.168 0.748 0.551 0.918 0.694 CB 1.436 50 residues pruned to eliminate duplicates Z: 141 76.029 2.263 0.858 0.543 0.929 0.600 CB 1.578 141 residues pruned to eliminate duplicates Z: 138 75.131 2.251 0.834 0.551 0.912 0.577 CB 1.622 138 residues pruned to eliminate duplicates Z: 207 103.526 2.352 0.856 0.568 0.942 0.587 CB 1.644 207 residues pruned to eliminate duplicates Z: 48 36.808 2.132 0.836 0.564 0.915 0.532 CB 1.408 48 residues pruned to eliminate duplicates Z: 44 34.215 2.111 0.688 0.576 0.907 0.628 CB 1.500 44 residues pruned to eliminate duplicates Z: 64 34.398 2.057 0.630 0.491 0.905 0.587 CB 1.442 64 residues pruned to eliminate duplicates Z: 62 39.086 2.114 0.696 0.515 0.918 0.508 CB 1.498 62 residues pruned to eliminate duplicates Z: 44 35.511 2.156 0.748 0.564 0.884 0.674 CB 1.528 44 residues pruned to eliminate duplicates Z: 231 98.730 2.258 0.835 0.562 0.922 0.609 CB 1.605 231 residues pruned to eliminate duplicates Z: 50 36.305 2.108 0.695 0.563 0.898 0.714 CB 1.522 50 residues pruned to eliminate duplicates Z: 32 28.023 2.042 0.754 0.549 0.839 0.645 CB 1.596 32 residues pruned to eliminate duplicates Z: 109 59.021 2.182 0.781 0.503 0.926 0.583 CB 1.574 109 residues pruned to eliminate duplicates Z: 66 42.257 2.129 0.700 0.504 0.938 0.585 CB 1.538 66 residues pruned to eliminate duplicates Z: 60 41.375 2.131 0.744 0.536 0.932 0.678 CB 1.500 60 residues pruned to eliminate duplicates Z: 67 42.245 2.152 0.748 0.456 0.924 0.576 CB 1.565 67 residues pruned to eliminate duplicates Z: 53 35.593 2.128 0.710 0.531 0.885 0.577 CB 1.487 53 residues pruned to eliminate duplicates Z: 77 39.971 2.139 0.759 0.455 0.868 0.605 CB 1.470 77 residues pruned to eliminate duplicates Z: 191 99.522 2.277 0.920 0.578 0.942 0.642 CB 1.626 191 residues pruned to eliminate duplicates Z: 75 46.084 2.141 0.804 0.488 0.919 0.541 CB 1.528 75 residues pruned to eliminate duplicates Z: 109 52.787 2.178 0.727 0.480 0.898 0.537 CB 1.535 109 residues pruned to eliminate duplicates Z: 60 38.343 2.093 0.718 0.522 0.898 0.576 CB 1.511 60 residues pruned to eliminate duplicates Z: 63 42.887 2.152 0.735 0.510 0.903 0.613 CB 1.600 63 residues pruned to eliminate duplicates Z: 89 47.212 2.127 0.758 0.483 0.920 0.568 CB 1.487 89 residues pruned to eliminate duplicates Z: 65 41.176 2.113 0.743 0.508 0.922 0.547 CB 1.504 65 residues pruned to eliminate duplicates Z: 62 38.197 2.122 0.792 0.471 0.885 0.443 CB 1.496 62 residues pruned to eliminate duplicates Z: 65 42.046 2.136 0.772 0.500 0.891 0.578 CB 1.559 65 residues pruned to eliminate duplicates Z: 200 91.895 2.244 0.846 0.571 0.915 0.618 CB 1.606 200 residues pruned to eliminate duplicates Z: 31 23.028 1.996 0.699 0.320 1.000 0.567 CB 1.512 31 residues pruned to eliminate duplicates Z: 206 96.080 2.272 0.846 0.586 0.941 0.620 CB 1.564 206 residues pruned to eliminate duplicates Z: 104 67.244 2.274 0.858 0.516 0.942 0.602 CB 1.640 104 residues pruned to eliminate duplicates Z: 32 22.554 2.040 0.810 0.278 0.903 0.548 CB 1.560 32 residues pruned to eliminate duplicates Z: 124 64.297 2.209 0.779 0.528 0.927 0.650 CB 1.548 124 residues pruned to eliminate duplicates Z: 76 42.502 2.110 0.702 0.447 0.933 0.547 CB 1.546 76 residues pruned to eliminate duplicates Z: 198 90.530 2.262 0.838 0.573 0.914 0.619 CB 1.582 198 residues pruned to eliminate duplicates Z: 27 18.869 2.107 0.607 0.241 0.923 0.385 CB 1.598 27 residues pruned to eliminate duplicates Z: 90 44.848 2.123 0.717 0.465 0.899 0.562 CB 1.504 90 residues pruned to eliminate duplicates Z: 126 67.274 2.254 0.884 0.503 0.912 0.592 CB 1.550 126 residues pruned to eliminate duplicates Z: 148 66.076 2.201 0.757 0.506 0.905 0.599 CB 1.549 148 residues pruned to eliminate duplicates Z: 65 40.809 2.112 0.758 0.471 0.891 0.625 CB 1.588 65 residues pruned to eliminate duplicates Z: 19 12.682 1.893 0.750 0.240 0.833 0.444 CB 1.464 19 residues pruned to eliminate duplicates Z: 110 77.062 2.316 1.027 0.570 0.908 0.569 CB 1.618 110 residues pruned to eliminate duplicates Z: 175 89.589 2.284 0.876 0.572 0.925 0.603 CB 1.599 175 residues pruned to eliminate duplicates Z: 30 25.101 2.050 0.757 0.401 0.966 0.690 CB 1.488 30 residues pruned to eliminate duplicates Z: 149 93.325 2.321 0.953 0.596 0.939 0.635 CB 1.644 149 residues pruned to eliminate duplicates Z: 195 96.429 2.274 0.877 0.589 0.923 0.598 CB 1.614 195 residues pruned to eliminate duplicates Z: 121 70.189 2.238 0.834 0.548 0.950 0.658 CB 1.568 121 residues pruned to eliminate duplicates Z: 158 90.458 2.291 0.952 0.593 0.943 0.618 CB 1.567 158 residues pruned to eliminate duplicates Z: 145 86.554 2.305 0.914 0.616 0.917 0.583 CB 1.598 145 residues pruned to eliminate duplicates Z: 138 90.082 2.334 0.931 0.620 0.934 0.664 CB 1.633 138 residues pruned to eliminate duplicates Z: 158 90.128 2.307 0.925 0.593 0.917 0.618 CB 1.615 158 residues pruned to eliminate duplicates Z: 151 83.050 2.240 0.917 0.580 0.913 0.633 CB 1.601 151 residues pruned to eliminate duplicates Z: 81 66.051 2.326 0.862 0.577 0.938 0.600 CB 1.689 81 residues pruned to eliminate duplicates Z: 107 78.260 2.330 0.968 0.591 0.934 0.632 CB 1.627 107 residues pruned to eliminate duplicates Z: 88 67.868 2.341 0.890 0.569 0.920 0.667 CB 1.673 88 residues pruned to eliminate duplicates Z: 89 56.306 2.213 0.803 0.491 0.955 0.591 CB 1.591 89 residues pruned to eliminate duplicates Z: 61 52.090 2.282 0.873 0.581 0.933 0.700 CB 1.559 61 residues pruned to eliminate duplicates Z: 25 34.590 2.262 0.864 0.578 0.958 0.583 CB 1.621 25 residues pruned to eliminate duplicates Z: 138 83.606 2.289 0.949 0.576 0.920 0.620 CB 1.618 138 residues pruned to eliminate duplicates Z: 155 96.230 2.323 0.984 0.606 0.935 0.643 CB 1.626 155 residues pruned to eliminate duplicates Z: 68 50.462 2.277 0.831 0.545 0.910 0.657 CB 1.555 68 residues pruned to eliminate duplicates Z: 138 84.077 2.290 0.882 0.617 0.942 0.650 CB 1.585 138 residues pruned to eliminate duplicates Z: 170 90.652 2.269 0.845 0.588 0.964 0.633 CB 1.588 170 residues pruned to eliminate duplicates Z: 138 91.985 2.323 0.960 0.627 0.942 0.642 CB 1.626 138 residues pruned to eliminate duplicates Z: 78 70.584 2.370 0.882 0.601 0.961 0.584 CB 1.705 78 residues pruned to eliminate duplicates Z: 147 83.504 2.302 0.852 0.597 0.925 0.589 CB 1.599 147 residues pruned to eliminate duplicates Z: 80 68.330 2.358 0.862 0.580 0.949 0.620 CB 1.707 80 residues pruned to eliminate duplicates Z: 106 79.567 2.317 0.939 0.644 0.924 0.667 CB 1.636 106 residues pruned to eliminate duplicates Z: 129 89.048 2.310 0.949 0.641 0.938 0.664 CB 1.635 129 residues pruned to eliminate duplicates Z: 102 79.341 2.331 0.877 0.647 0.950 0.604 CB 1.655 102 residues pruned to eliminate duplicates Z: 72 50.513 2.220 0.873 0.532 0.915 0.634 CB 1.527 72 residues pruned to eliminate duplicates Z: 101 84.441 2.348 0.991 0.657 0.950 0.680 CB 1.643 101 residues pruned to eliminate duplicates Z: 116 88.422 2.326 1.050 0.647 0.930 0.626 CB 1.620 116 residues pruned to eliminate duplicates Z: 53 57.703 2.395 0.862 0.619 0.923 0.654 CB 1.737 53 residues pruned to eliminate duplicates Z: 79 67.281 2.353 0.884 0.596 0.936 0.679 CB 1.675 79 residues pruned to eliminate duplicates Z: 108 81.376 2.328 0.992 0.620 0.925 0.617 CB 1.636 108 residues pruned to eliminate duplicates Z: 37 50.289 2.366 1.100 0.581 0.944 0.639 CB 1.652 37 residues pruned to eliminate duplicates Z: 135 89.964 2.322 0.937 0.617 0.940 0.627 CB 1.644 135 residues pruned to eliminate duplicates Z: 163 86.863 2.257 0.907 0.580 0.914 0.549 CB 1.607 163 residues pruned to eliminate duplicates Z: 62 55.304 2.296 0.897 0.584 0.967 0.590 CB 1.550 62 residues pruned to eliminate duplicates Z: 64 65.865 2.397 0.970 0.606 0.905 0.635 CB 1.756 64 residues pruned to eliminate duplicates Z: 27 28.262 2.191 0.882 0.540 0.885 0.538 CB 1.461 27 residues pruned to eliminate duplicates Z: 84 65.869 2.308 0.991 0.576 0.904 0.590 CB 1.618 84 residues pruned to eliminate duplicates Z: 114 86.173 2.333 0.986 0.625 0.929 0.628 CB 1.674 114 residues pruned to eliminate duplicates Z: 36 44.658 2.258 1.167 0.604 0.914 0.657 CB 1.528 36 residues pruned to eliminate duplicates Z: 77 70.058 2.336 1.056 0.605 0.934 0.632 CB 1.621 77 residues pruned to eliminate duplicates Z: 36 42.067 2.342 0.910 0.576 0.914 0.543 CB 1.616 36 residues pruned to eliminate duplicates Z: 64 51.020 2.293 0.908 0.535 0.889 0.556 CB 1.596 64 residues pruned to eliminate duplicates Z: 58 55.323 2.325 0.953 0.595 0.965 0.632 CB 1.527 58 residues pruned to eliminate duplicates Z: 146 87.475 2.307 0.907 0.611 0.938 0.621 CB 1.584 146 residues pruned to eliminate duplicates Z: 35 44.109 2.324 1.015 0.594 0.912 0.647 CB 1.620 35 residues pruned to eliminate duplicates Z: 102 82.703 2.337 1.037 0.651 0.911 0.683 CB 1.649 102 residues pruned to eliminate duplicates Z: 157 93.218 2.304 0.955 0.598 0.942 0.603 CB 1.601 157 residues pruned to eliminate duplicates Z: 70 77.209 2.370 1.146 0.644 0.942 0.652 CB 1.695 70 residues pruned to eliminate duplicates Z: 36 47.027 2.342 1.062 0.584 0.943 0.686 CB 1.611 36 residues pruned to eliminate duplicates Z: 101 85.725 2.334 1.067 0.658 0.940 0.640 CB 1.633 101 residues pruned to eliminate duplicates Z: 33 47.139 2.320 1.129 0.622 0.938 0.719 CB 1.604 33 residues pruned to eliminate duplicates Z: 64 72.340 2.388 1.101 0.639 0.952 0.714 CB 1.674 64 residues pruned to eliminate duplicates Z: 209 92.476 2.215 0.931 0.569 0.918 0.558 CB 1.528 209 residues pruned to eliminate duplicates Z: 115 86.579 2.332 1.033 0.618 0.912 0.605 CB 1.677 115 residues pruned to eliminate duplicates Z: 128 88.671 2.320 0.969 0.639 0.929 0.677 CB 1.628 128 residues pruned to eliminate duplicates Z: 84 69.189 2.285 0.980 0.632 0.928 0.566 CB 1.598 84 residues pruned to eliminate duplicates Z: 85 67.822 2.286 0.933 0.622 0.905 0.560 CB 1.650 85 residues pruned to eliminate duplicates Z: 20 35.783 2.496 0.855 0.634 0.895 0.579 CA 1.748 20 residues pruned to eliminate duplicates Z: 32 50.544 2.403 1.069 0.644 0.871 0.742 CB 1.832 32 residues pruned to eliminate duplicates Z: 21 38.374 2.440 0.819 0.628 0.900 0.650 CA 1.905 21 residues pruned to eliminate duplicates Z: 70 73.739 2.328 1.060 0.677 0.942 0.710 CB 1.669 70 residues pruned to eliminate duplicates Z: 20 36.856 2.458 0.787 0.644 0.895 0.632 CA 1.880 20 residues pruned to eliminate duplicates Z: 22 34.673 2.369 0.889 0.565 0.857 0.619 CA 1.852 22 residues pruned to eliminate duplicates Z: 88 75.668 2.327 0.990 0.658 0.931 0.655 CB 1.626 88 residues pruned to eliminate duplicates Z: 88 77.542 2.264 1.076 0.642 0.954 0.644 CB 1.623 88 residues pruned to eliminate duplicates Z: 82 74.526 2.316 0.968 0.668 0.951 0.642 CB 1.636 82 residues pruned to eliminate duplicates Z: 53 65.454 2.399 1.088 0.633 0.942 0.577 CB 1.697 53 residues pruned to eliminate duplicates Z: 77 64.487 2.343 0.959 0.587 0.934 0.618 CB 1.587 77 residues pruned to eliminate duplicates Z: 33 45.650 2.368 1.029 0.620 0.844 0.656 CB 1.778 33 residues pruned to eliminate duplicates Z: 81 60.992 2.230 0.920 0.603 0.900 0.512 CB 1.604 81 residues pruned to eliminate duplicates Z: 32 53.696 2.393 1.136 0.652 0.935 0.645 CB 1.752 32 residues pruned to eliminate duplicates Z: 70 69.789 2.298 0.989 0.697 0.913 0.667 CB 1.682 70 residues pruned to eliminate duplicates Z: 58 67.159 2.400 1.064 0.618 0.930 0.561 CB 1.728 58 residues pruned to eliminate duplicates Z: 88 72.364 2.295 0.948 0.643 0.954 0.609 CB 1.592 88 residues pruned to eliminate duplicates Z: 113 84.029 2.298 1.073 0.636 0.911 0.580 CB 1.611 113 residues pruned to eliminate duplicates Z: 71 68.047 2.275 0.986 0.675 0.929 0.600 CB 1.649 71 residues pruned to eliminate duplicates Z: 64 63.676 2.255 1.051 0.676 0.952 0.698 CB 1.549 64 residues pruned to eliminate duplicates Z: 54 53.602 2.183 1.039 0.684 0.925 0.698 CB 1.511 54 residues pruned to eliminate duplicates Z: 88 75.933 2.304 1.017 0.669 0.931 0.632 CB 1.610 88 residues pruned to eliminate duplicates Z: 41 53.927 2.303 1.088 0.663 0.900 0.600 CB 1.694 41 residues pruned to eliminate duplicates Z: 212 98.308 2.249 0.923 0.570 0.929 0.621 CB 1.575 212 residues pruned to eliminate duplicates Z: 82 79.353 2.330 1.085 0.664 0.951 0.642 CB 1.640 82 residues pruned to eliminate duplicates Z: 85 77.789 2.284 1.046 0.637 0.964 0.560 CB 1.657 85 residues pruned to eliminate duplicates Z: 82 60.991 2.214 0.987 0.587 0.926 0.617 CB 1.531 82 residues pruned to eliminate duplicates Z: 70 65.712 2.296 0.954 0.647 0.942 0.652 CB 1.632 70 residues pruned to eliminate duplicates Z: 67 57.288 2.255 0.881 0.609 0.924 0.561 CB 1.621 67 residues pruned to eliminate duplicates Z: 76 61.083 2.256 0.949 0.626 0.933 0.640 CB 1.526 76 residues pruned to eliminate duplicates Z: 86 76.914 2.323 1.021 0.636 0.953 0.600 CB 1.641 86 residues pruned to eliminate duplicates Z: 57 58.565 2.234 1.025 0.625 0.964 0.696 CB 1.594 57 residues pruned to eliminate duplicates Z: 83 72.352 2.292 1.048 0.615 0.939 0.622 CB 1.626 83 residues pruned to eliminate duplicates Z: 89 73.825 2.286 0.971 0.642 0.955 0.648 CB 1.603 89 residues pruned to eliminate duplicates Z: 84 77.995 2.292 1.034 0.659 0.964 0.699 CB 1.644 84 residues pruned to eliminate duplicates Z: 71 72.579 2.279 1.112 0.649 0.957 0.657 CB 1.638 71 residues pruned to eliminate duplicates Z: 144 96.969 2.328 0.994 0.630 0.951 0.622 CB 1.626 144 residues pruned to eliminate duplicates Z: 90 66.805 2.277 0.899 0.608 0.921 0.607 CB 1.604 90 residues pruned to eliminate duplicates Z: 82 78.783 2.328 1.077 0.647 0.975 0.654 CB 1.618 82 residues pruned to eliminate duplicates Z: 88 72.031 2.306 0.981 0.633 0.931 0.621 CB 1.603 88 residues pruned to eliminate duplicates Z: 45 50.337 2.190 0.981 0.661 0.955 0.591 CB 1.579 45 residues pruned to eliminate duplicates Z: 89 68.955 2.276 0.875 0.618 0.955 0.545 CB 1.614 89 residues pruned to eliminate duplicates Z: 50 51.607 2.215 1.092 0.606 0.939 0.571 CB 1.532 50 residues pruned to eliminate duplicates Z: 88 72.667 2.301 1.028 0.650 0.931 0.586 CB 1.559 88 residues pruned to eliminate duplicates Z: 70 71.615 2.326 0.990 0.668 0.957 0.638 CB 1.668 70 residues pruned to eliminate duplicates Z: 83 67.551 2.265 0.981 0.618 0.939 0.573 CB 1.584 83 residues pruned to eliminate duplicates Z: 70 71.544 2.282 1.076 0.670 0.942 0.696 CB 1.650 70 residues pruned to eliminate duplicates Z: 69 62.023 2.261 0.994 0.616 0.956 0.618 CB 1.564 69 residues pruned to eliminate duplicates Z: 113 77.903 2.298 1.013 0.617 0.938 0.580 CB 1.519 113 residues pruned to eliminate duplicates Z: 130 90.390 2.303 1.025 0.631 0.946 0.589 CB 1.595 130 residues pruned to eliminate duplicates Z: 71 71.116 2.298 0.977 0.665 0.971 0.614 CB 1.653 71 residues pruned to eliminate duplicates Z: 76 72.680 2.273 1.078 0.618 0.973 0.600 CB 1.634 76 residues pruned to eliminate duplicates Z: 53 52.866 2.172 0.917 0.655 0.981 0.673 CB 1.554 53 residues pruned to eliminate duplicates Z: 70 62.205 2.260 0.990 0.627 0.913 0.594 CB 1.618 70 residues pruned to eliminate duplicates Z: 72 71.310 2.291 1.059 0.637 0.944 0.606 CB 1.672 72 residues pruned to eliminate duplicates Z: 84 70.401 2.297 1.013 0.623 0.916 0.651 CB 1.624 84 residues pruned to eliminate duplicates Z: 85 73.022 2.283 1.057 0.602 0.952 0.571 CB 1.616 85 residues pruned to eliminate duplicates Z: 31 33.594 2.137 0.875 0.547 0.933 0.500 CB 1.566 31 residues pruned to eliminate duplicates Z: 94 68.148 2.260 0.915 0.617 0.935 0.645 CB 1.562 94 residues pruned to eliminate duplicates Z: 80 62.231 2.217 0.948 0.615 0.937 0.658 CB 1.552 80 residues pruned to eliminate duplicates Z: 72 68.870 2.290 0.972 0.646 0.944 0.718 CB 1.673 72 residues pruned to eliminate duplicates Z: 71 70.607 2.312 1.079 0.642 0.943 0.600 CB 1.630 71 residues pruned to eliminate duplicates Z: 88 78.944 2.306 1.107 0.645 0.943 0.586 CB 1.614 88 residues pruned to eliminate duplicates Z: 74 55.689 2.228 0.941 0.608 0.918 0.603 CB 1.483 74 residues pruned to eliminate duplicates Z: 83 61.686 2.209 0.968 0.590 0.915 0.561 CB 1.571 83 residues pruned to eliminate duplicates Z: 77 71.076 2.284 1.024 0.622 0.921 0.632 CB 1.706 77 residues pruned to eliminate duplicates Z: 114 91.568 2.330 1.094 0.636 0.956 0.593 CB 1.626 114 residues pruned to eliminate duplicates Z: 19 23.566 2.251 0.751 0.506 0.889 0.611 CB 1.576 19 residues pruned to eliminate duplicates Z: 18 28.466 2.152 1.099 0.529 0.941 0.588 CB 1.579 18 residues pruned to eliminate duplicates Z: 119 92.591 2.325 1.104 0.630 0.958 0.619 CB 1.609 119 residues pruned to eliminate duplicates Z: 88 73.331 2.306 1.050 0.630 0.920 0.621 CB 1.601 88 residues pruned to eliminate duplicates Z: 18 27.974 2.225 1.036 0.557 0.941 0.647 CB 1.506 18 residues pruned to eliminate duplicates Z: 85 59.923 2.239 0.899 0.573 0.905 0.583 CB 1.584 85 residues pruned to eliminate duplicates Z: 87 74.587 2.275 1.061 0.611 0.942 0.616 CB 1.639 87 residues pruned to eliminate duplicates Z: 89 71.260 2.285 1.005 0.599 0.932 0.591 CB 1.620 89 residues pruned to eliminate duplicates Z: 10 28.319 2.293 1.282 0.633 0.889 0.556 CB 1.791 10 residues pruned to eliminate duplicates Z: 9 11.920 1.997 0.995 0.660 0.750 0.625 CA 1.216 9 residues pruned to eliminate duplicates Z: 6 3.357 1.359 0.747 0.381 0.800 0.400 CA 0.897 6 residues pruned to eliminate duplicates Z: 10 15.233 2.027 0.913 0.606 0.778 0.778 CB 1.522 10 residues pruned to eliminate duplicates Z: 7 14.495 2.211 0.848 0.717 0.833 0.667 CB 1.428 7 residues pruned to eliminate duplicates Z: 8 13.874 2.045 0.934 0.758 0.857 0.714 CB 1.230 8 residues pruned to eliminate duplicates Z: 71 45.877 2.076 0.772 0.526 0.943 0.643 CB 1.540 71 residues pruned to eliminate duplicates Z: 20 8.919 1.772 0.449 0.253 0.842 0.474 CB 1.257 20 residues pruned to eliminate duplicates Z: 75 42.146 2.012 0.724 0.523 0.946 0.541 CB 1.459 75 residues pruned to eliminate duplicates Z: 82 50.350 2.107 0.766 0.580 0.914 0.642 CB 1.524 82 residues pruned to eliminate duplicates Z: 39 22.060 1.889 0.496 0.475 0.921 0.553 CB 1.410 39 residues pruned to eliminate duplicates Z: 74 38.537 2.017 0.698 0.497 0.890 0.616 CB 1.483 74 residues pruned to eliminate duplicates Z: 42 24.892 1.928 0.562 0.478 0.951 0.561 CB 1.388 42 residues pruned to eliminate duplicates Z: 20 8.797 1.716 0.415 0.247 0.947 0.526 CA 1.174 19 residues pruned to eliminate duplicates Z: 9 7.574 1.614 0.834 0.356 0.875 0.375 CA 1.208 9 residues pruned to eliminate duplicates Z: 138 82.511 2.212 0.864 0.620 0.949 0.664 CB 1.608 138 residues pruned to eliminate duplicates Z: 140 82.645 2.214 0.871 0.611 0.964 0.626 CB 1.579 140 residues pruned to eliminate duplicates Z: 39 18.903 1.869 0.404 0.447 0.895 0.553 CB 1.379 39 residues pruned to eliminate duplicates Z: 39 19.756 1.860 0.465 0.430 0.947 0.605 CB 1.335 39 residues pruned to eliminate duplicates Z: 28 18.053 1.951 0.517 0.558 0.815 0.667 CB 1.361 28 residues pruned to eliminate duplicates Z: 75 44.416 2.053 0.808 0.509 0.946 0.635 CB 1.458 75 residues pruned to eliminate duplicates Z: 28 20.962 1.972 0.624 0.559 0.852 0.667 CB 1.395 28 residues pruned to eliminate duplicates Z: 93 49.065 2.110 0.762 0.533 0.902 0.641 CB 1.476 93 residues pruned to eliminate duplicates Z: 35 23.103 1.989 0.582 0.490 0.912 0.706 CB 1.395 35 residues pruned to eliminate duplicates Z: 32 27.150 2.008 0.684 0.534 0.935 0.742 CB 1.490 32 residues pruned to eliminate duplicates Z: 148 80.508 2.202 0.863 0.604 0.932 0.612 CB 1.572 148 residues pruned to eliminate duplicates Z: 40 22.625 1.888 0.535 0.466 0.923 0.590 CB 1.402 40 residues pruned to eliminate duplicates Z: 73 52.334 2.149 0.860 0.593 0.931 0.583 CB 1.516 73 residues pruned to eliminate duplicates Z: 156 73.217 2.153 0.836 0.575 0.903 0.613 CB 1.532 156 residues pruned to eliminate duplicates Z: 30 19.014 1.889 0.568 0.561 0.862 0.552 CB 1.303 30 residues pruned to eliminate duplicates Z: 79 55.348 2.180 0.905 0.581 0.910 0.615 CB 1.534 79 residues pruned to eliminate duplicates Z: 33 23.915 1.962 0.636 0.503 0.938 0.656 CB 1.400 33 residues pruned to eliminate duplicates Z: 27 22.631 1.958 0.644 0.530 0.923 0.462 CA 1.450 27 residues pruned to eliminate duplicates Z: 36 23.085 1.925 0.510 0.473 0.971 0.571 CB 1.420 36 residues pruned to eliminate duplicates Z: 30 21.131 1.826 0.629 0.584 0.931 0.483 CA 1.307 30 residues pruned to eliminate duplicates Z: 155 73.209 2.126 0.812 0.553 0.942 0.643 CB 1.545 155 residues pruned to eliminate duplicates Z: 152 74.019 2.162 0.823 0.567 0.914 0.596 CB 1.567 152 residues pruned to eliminate duplicates Z: 48 54.613 2.281 0.945 0.662 0.936 0.681 CB 1.650 48 residues pruned to eliminate duplicates Z: 49 55.648 2.264 1.046 0.623 0.958 0.625 CB 1.611 49 residues pruned to eliminate duplicates Z: 144 79.972 2.203 0.859 0.602 0.923 0.699 CB 1.606 144 residues pruned to eliminate duplicates Z: 60 46.605 2.107 0.855 0.564 0.949 0.627 CB 1.537 60 residues pruned to eliminate duplicates Z: 75 35.525 2.045 0.615 0.507 0.865 0.622 CB 1.436 75 residues pruned to eliminate duplicates Z: 35 40.744 2.210 1.012 0.575 0.882 0.618 CB 1.657 35 residues pruned to eliminate duplicates Z: 120 77.311 2.237 0.852 0.631 0.941 0.647 CB 1.607 120 residues pruned to eliminate duplicates Z: 127 74.496 2.180 0.898 0.598 0.921 0.627 CB 1.587 127 residues pruned to eliminate duplicates Z: 70 59.975 2.232 0.933 0.635 0.928 0.638 CB 1.590 70 residues pruned to eliminate duplicates Z: 35 49.492 2.249 1.117 0.610 0.971 0.735 CB 1.654 35 residues pruned to eliminate duplicates Z: 36 42.570 2.200 1.045 0.586 0.914 0.657 CB 1.611 36 residues pruned to eliminate duplicates Z: 115 83.704 2.243 1.027 0.638 0.939 0.658 CB 1.614 115 residues pruned to eliminate duplicates Z: 158 79.452 2.158 0.833 0.601 0.949 0.580 CB 1.535 158 residues pruned to eliminate duplicates Z: 60 45.072 2.142 0.879 0.563 0.915 0.559 CB 1.499 60 residues pruned to eliminate duplicates Z: 73 47.590 2.059 0.907 0.545 0.931 0.611 CB 1.470 73 residues pruned to eliminate duplicates Z: 64 49.492 2.134 0.871 0.594 0.921 0.651 CB 1.551 64 residues pruned to eliminate duplicates Z: 145 75.018 2.184 0.832 0.609 0.896 0.653 CB 1.572 145 residues pruned to eliminate duplicates Z: 37 43.937 2.226 1.095 0.577 0.944 0.611 CB 1.543 37 residues pruned to eliminate duplicates Z: 36 44.685 2.210 1.124 0.592 0.971 0.657 CB 1.517 36 residues pruned to eliminate duplicates Z: 141 82.909 2.203 0.923 0.630 0.929 0.664 CB 1.577 142 residues pruned to eliminate duplicates Z: 16 58.131 2.344 1.491 0.941 1.000 0.733 CB 1.784 16 residues pruned to eliminate duplicates Z: 66 57.755 2.237 0.981 0.603 0.938 0.615 CB 1.562 66 residues pruned to eliminate duplicates Z: 159 80.315 2.154 0.842 0.589 0.943 0.608 CB 1.569 159 residues pruned to eliminate duplicates Z: 120 84.618 2.226 1.032 0.638 0.941 0.613 CB 1.601 119 residues pruned to eliminate duplicates Z: 16 44.443 2.199 1.555 0.897 0.867 0.467 CA 1.688 16 residues pruned to eliminate duplicates Z: 115 70.538 2.193 0.971 0.598 0.912 0.596 CB 1.525 115 residues pruned to eliminate duplicates Z: 49 57.410 2.256 1.108 0.648 0.958 0.562 CB 1.583 49 residues pruned to eliminate duplicates Z: 149 79.099 2.184 0.887 0.594 0.919 0.554 CB 1.569 149 residues pruned to eliminate duplicates Z: 91 59.904 2.172 0.972 0.571 0.900 0.567 CB 1.529 91 residues pruned to eliminate duplicates Z: 71 61.223 2.242 0.967 0.649 0.914 0.571 CB 1.580 71 residues pruned to eliminate duplicates Z: 122 76.025 2.203 0.916 0.610 0.926 0.636 CB 1.594 122 residues pruned to eliminate duplicates Z: 53 53.218 2.221 1.029 0.599 0.923 0.654 CB 1.615 53 residues pruned to eliminate duplicates Z: 121 82.087 2.235 0.977 0.632 0.933 0.633 CB 1.605 121 residues pruned to eliminate duplicates Z: 154 80.741 2.149 0.893 0.597 0.941 0.614 CB 1.553 154 residues pruned to eliminate duplicates Z: 74 57.084 2.158 0.925 0.611 0.918 0.630 CB 1.578 74 residues pruned to eliminate duplicates Z: 84 63.135 2.227 0.832 0.626 0.928 0.602 CB 1.627 84 residues pruned to eliminate duplicates Z: 155 78.844 2.153 0.871 0.595 0.942 0.610 CB 1.530 155 residues pruned to eliminate duplicates Z: 89 66.200 2.222 0.866 0.635 0.943 0.636 CB 1.589 89 residues pruned to eliminate duplicates Z: 17 32.041 2.172 1.021 0.711 0.938 0.688 CB 1.607 17 residues pruned to eliminate duplicates Z: 130 77.538 2.177 0.982 0.615 0.922 0.543 CB 1.538 130 residues pruned to eliminate duplicates Z: 88 66.265 2.223 0.833 0.645 0.943 0.644 CB 1.617 88 residues pruned to eliminate duplicates Z: 91 64.960 2.189 0.920 0.622 0.933 0.600 CB 1.556 91 residues pruned to eliminate duplicates Z: 76 62.529 2.205 0.955 0.648 0.933 0.627 CB 1.562 76 residues pruned to eliminate duplicates Z: 141 81.698 2.195 0.923 0.624 0.914 0.643 CB 1.592 141 residues pruned to eliminate duplicates Z: 146 73.898 2.177 0.841 0.563 0.924 0.545 CB 1.559 146 residues pruned to eliminate duplicates Z: 88 63.851 2.214 0.866 0.619 0.920 0.552 CB 1.610 88 residues pruned to eliminate duplicates Z: 119 79.764 2.222 1.001 0.620 0.924 0.610 CB 1.596 119 residues pruned to eliminate duplicates Z: 85 72.118 2.239 0.998 0.661 0.940 0.655 CB 1.611 88 residues pruned to eliminate duplicates Z: 8 8.242 1.765 0.782 0.412 1.000 0.286 CA 1.086 8 residues pruned to eliminate duplicates Z: 72 60.897 2.213 0.845 0.644 0.958 0.606 CB 1.616 72 residues pruned to eliminate duplicates Z: 88 69.157 2.231 0.859 0.660 0.954 0.667 CB 1.616 88 residues pruned to eliminate duplicates Z: 91 63.475 2.190 0.867 0.615 0.933 0.622 CB 1.572 93 residues pruned to eliminate duplicates Z: 6 4.303 1.637 0.724 0.277 0.800 0.600 CA 1.097 6 residues pruned to eliminate duplicates Z: 153 80.993 2.165 0.945 0.584 0.921 0.651 CB 1.563 160 residues pruned to eliminate duplicates Z: 6 3.560 1.610 0.738 0.251 0.600 0.200 O 1.262 6 residues pruned to eliminate duplicates Z: 96 64.104 2.160 0.942 0.633 0.905 0.674 CB 1.529 96 residues pruned to eliminate duplicates Z: 69 59.258 2.237 0.867 0.641 0.941 0.676 CB 1.603 69 residues pruned to eliminate duplicates Z: 140 85.937 2.197 0.943 0.635 0.957 0.619 CB 1.572 140 residues pruned to eliminate duplicates Z: 140 82.790 2.194 0.849 0.622 0.971 0.612 CB 1.588 140 residues pruned to eliminate duplicates Z: 89 70.079 2.215 0.958 0.628 0.943 0.659 CB 1.619 89 residues pruned to eliminate duplicates Z: 86 72.732 2.225 0.953 0.659 0.976 0.706 CB 1.605 83 residues pruned to eliminate duplicates Z: 11 15.635 1.815 0.587 0.811 0.900 0.800 CB 1.455 11 residues pruned to eliminate duplicates Z: 82 70.799 2.252 0.918 0.665 0.963 0.716 CB 1.624 82 residues pruned to eliminate duplicates Z: 115 85.662 2.256 1.037 0.645 0.947 0.649 CB 1.609 115 residues pruned to eliminate duplicates Z: 90 64.092 2.186 0.875 0.637 0.933 0.618 CB 1.564 90 residues pruned to eliminate duplicates Z: 85 67.034 2.230 0.858 0.647 0.940 0.655 CB 1.637 85 residues pruned to eliminate duplicates Z: 88 69.119 2.229 0.916 0.637 0.931 0.678 CB 1.640 85 residues pruned to eliminate duplicates Z: 9 20.958 2.097 0.618 0.889 1.000 0.875 CA 1.572 9 residues pruned to eliminate duplicates Z: 65 57.145 2.209 0.878 0.669 0.922 0.625 CB 1.598 65 residues pruned to eliminate duplicates Z: 66 59.079 2.203 0.896 0.686 0.923 0.692 CB 1.602 66 residues pruned to eliminate duplicates Z: 88 68.157 2.219 0.912 0.637 0.954 0.632 CB 1.588 88 residues pruned to eliminate duplicates Z: 47 48.968 2.213 0.857 0.634 0.978 0.478 CB 1.584 47 residues pruned to eliminate duplicates Z: 85 70.258 2.213 0.948 0.658 0.952 0.714 CB 1.613 85 residues pruned to eliminate duplicates Z: 120 75.327 2.203 0.933 0.606 0.933 0.588 CB 1.572 120 residues pruned to eliminate duplicates Z: 88 67.484 2.218 0.850 0.648 0.954 0.690 CB 1.610 88 residues pruned to eliminate duplicates Z: 91 64.745 2.185 0.868 0.618 0.956 0.667 CB 1.565 91 residues pruned to eliminate duplicates Z: 142 82.350 2.187 0.913 0.621 0.943 0.596 CB 1.568 152 residues pruned to eliminate duplicates Z: 15 31.227 2.121 1.006 0.884 1.000 0.571 CA 1.418 15 residues pruned to eliminate duplicates Z: 122 78.416 2.219 0.893 0.626 0.942 0.645 CB 1.599 122 residues pruned to eliminate duplicates Z: 87 69.052 2.229 0.910 0.663 0.953 0.756 CB 1.578 87 residues pruned to eliminate duplicates Z: 123 80.433 2.191 0.955 0.610 0.959 0.631 CB 1.596 123 residues pruned to eliminate duplicates Z: 110 77.231 2.186 1.078 0.636 0.945 0.596 CB 1.517 110 residues pruned to eliminate duplicates Z: 104 76.083 2.232 0.911 0.648 0.942 0.631 CB 1.626 104 residues pruned to eliminate duplicates Z: 85 69.047 2.238 0.979 0.651 0.905 0.667 CB 1.633 85 residues pruned to eliminate duplicates Z: 88 64.930 2.219 0.930 0.628 0.920 0.586 CB 1.568 88 residues pruned to eliminate duplicates Z: 88 65.743 2.209 0.904 0.628 0.920 0.678 CB 1.616 88 residues pruned to eliminate duplicates Z: 88 70.422 2.212 0.889 0.655 0.966 0.701 CB 1.620 88 residues pruned to eliminate duplicates Z: 50 50.587 2.225 0.957 0.610 0.898 0.592 CB 1.665 52 residues pruned to eliminate duplicates Z: 10 19.106 2.119 0.703 0.773 1.000 0.667 CA 1.387 10 residues pruned to eliminate duplicates Z: 89 65.163 2.176 0.872 0.642 0.966 0.659 CB 1.546 89 residues pruned to eliminate duplicates Z: 114 87.795 2.246 1.097 0.651 0.947 0.655 CB 1.608 114 residues pruned to eliminate duplicates Z: 52 46.166 2.150 0.845 0.626 0.941 0.647 CB 1.538 52 residues pruned to eliminate duplicates Z: 158 82.132 2.150 0.898 0.595 0.955 0.599 CB 1.536 158 residues pruned to eliminate duplicates Z: 121 85.159 2.216 1.018 0.640 0.967 0.600 CB 1.577 121 residues pruned to eliminate duplicates Z: 51 49.965 2.197 0.876 0.603 0.940 0.620 CB 1.654 51 residues pruned to eliminate duplicates Z: 122 73.842 2.164 0.925 0.607 0.942 0.570 CB 1.546 122 residues pruned to eliminate duplicates Z: 92 71.157 2.199 0.946 0.637 0.956 0.659 CB 1.604 92 residues pruned to eliminate duplicates Z: 90 63.819 2.182 0.907 0.606 0.933 0.663 CB 1.577 90 residues pruned to eliminate duplicates Z: 92 63.805 2.160 0.952 0.609 0.923 0.582 CB 1.549 92 residues pruned to eliminate duplicates Z: 50 53.232 2.215 1.027 0.615 0.939 0.551 CB 1.619 50 residues pruned to eliminate duplicates Z: 74 58.574 2.179 0.911 0.641 0.932 0.658 CB 1.549 74 residues pruned to eliminate duplicates Z: 90 68.621 2.193 0.932 0.640 0.944 0.674 CB 1.596 90 residues pruned to eliminate duplicates Z: 89 70.350 2.229 0.943 0.647 0.943 0.716 CB 1.601 89 residues pruned to eliminate duplicates Z: 21 19.024 2.008 0.585 0.465 0.950 0.500 CB 1.459 21 residues pruned to eliminate duplicates Z: 91 68.639 2.197 0.964 0.641 0.933 0.656 CB 1.574 91 residues pruned to eliminate duplicates Z: 24 17.682 1.953 0.584 0.508 0.870 0.609 CB 1.359 24 residues pruned to eliminate duplicates Z: 52 42.340 2.166 0.759 0.611 0.902 0.608 CB 1.552 52 residues pruned to eliminate duplicates Z: 21 19.215 2.009 0.707 0.450 0.900 0.450 CB 1.466 21 residues pruned to eliminate duplicates Z: 120 81.590 2.216 0.988 0.647 0.950 0.672 CB 1.559 120 residues pruned to eliminate duplicates Z: 71 66.781 2.202 1.053 0.623 0.957 0.686 CB 1.642 71 residues pruned to eliminate duplicates Z: 46 50.860 2.266 0.917 0.626 0.933 0.556 CB 1.661 46 residues pruned to eliminate duplicates Z: 11 11.066 1.993 0.434 0.523 0.800 0.600 CB 1.497 11 residues pruned to eliminate duplicates Z: 9 11.086 2.054 0.391 0.591 0.875 0.625 CB 1.437 9 residues pruned to eliminate duplicates Z: 11 10.020 1.885 0.547 0.507 0.800 0.400 CA 1.349 11 residues pruned to eliminate duplicates Z: 119 81.611 2.223 0.996 0.626 0.941 0.551 CB 1.599 119 residues pruned to eliminate duplicates Z: 26 24.283 2.118 0.867 0.522 0.840 0.520 CB 1.430 25 residues pruned to eliminate duplicates 691 residues left after pruning, divided into chains as follows: A: 8 B: 9 C: 6 D: 6 E: 10 F: 16 G: 15 H: 112 I: 121 J: 229 K: 159 Residues blocked in groups of 2 to fit allocated memory (-u) CC for partial structure against native data = 31.40 % ------------------------------------------------------------------------------ Global autotracing cycle 4 = 0.300, Contrast = 0.507, Connect. = 0.726 for dens.mod. cycle 1 = 0.300, Contrast = 0.582, Connect. = 0.752 for dens.mod. cycle 2 = 0.300, Contrast = 0.681, Connect. = 0.784 for dens.mod. cycle 3 = 0.300, Contrast = 0.685, Connect. = 0.786 for dens.mod. cycle 4 = 0.300, Contrast = 0.694, Connect. = 0.788 for dens.mod. cycle 5 = 0.300, Contrast = 0.697, Connect. = 0.790 for dens.mod. cycle 6 = 0.300, Contrast = 0.702, Connect. = 0.792 for dens.mod. cycle 7 = 0.300, Contrast = 0.704, Connect. = 0.793 for dens.mod. cycle 8 = 0.300, Contrast = 0.706, Connect. = 0.794 for dens.mod. cycle 9 = 0.300, Contrast = 0.707, Connect. = 0.795 for dens.mod. cycle 10 NOGO map generated for regions about rotation axes (if any) 6705 peaks > 0.5 sigma used to seed fragment search Space for about 1274 unique residues taking solvent into account 1302 potential tripeptides employed #(CA) CFOM DenFit NH...O SecStr Rama98 Rama80 A: 20 38.865 2.339 1.029 0.834 0.895 0.789 CB 1.574 B: 13 47.676 2.493 1.052 0.920 1.000 0.750 CA 1.895 C: 14 36.533 2.356 0.777 0.884 1.000 0.692 CA 1.749 D: 14 39.281 2.429 0.894 0.899 0.923 0.846 CB 1.833 E: 13 35.228 2.429 0.702 0.862 1.000 0.833 CA 1.805 13 residues pruned to eliminate duplicates F: 13 40.575 2.593 0.705 0.890 1.000 0.833 CA 1.906 14 residues pruned to eliminate duplicates G: 18 32.442 2.248 0.574 0.916 1.000 0.882 CB 1.570 18 residues pruned to eliminate duplicates H: 14 42.083 2.380 1.157 0.793 0.923 0.615 CB 1.905 14 residues pruned to eliminate duplicates I: 14 43.571 2.294 1.166 0.851 0.923 0.692 CA 1.952 14 residues pruned to eliminate duplicates J: 14 43.453 2.327 1.020 0.856 1.000 0.769 CB 1.892 13 residues pruned to eliminate duplicates K: 12 34.955 2.566 0.692 0.896 0.909 0.727 CA 1.913 12 residues pruned to eliminate duplicates L: 18 40.787 2.194 0.901 0.931 1.000 0.706 CA 1.657 M: 13 42.653 2.467 0.991 0.912 0.917 0.917 CB 1.936 13 residues pruned to eliminate duplicates N: 17 41.765 2.326 1.177 0.925 0.938 0.562 CB 1.544 16 residues pruned to eliminate duplicates O: 13 41.440 2.513 0.801 0.920 1.000 0.750 CB 1.861 13 residues pruned to eliminate duplicates P: 16 51.650 2.382 1.104 0.928 1.000 0.867 CA 1.863 18 residues pruned to eliminate duplicates Q: 19 19.549 2.240 0.511 0.479 0.889 0.556 CB 1.564 R: 13 32.767 2.439 0.733 0.889 0.917 0.917 CA 1.757 13 residues pruned to eliminate duplicates S: 18 41.272 2.144 1.073 0.857 1.000 0.824 CB 1.660 18 residues pruned to eliminate duplicates T: 14 37.691 2.349 0.878 0.888 1.000 0.769 CA 1.707 14 residues pruned to eliminate duplicates U: 18 41.540 2.280 1.164 0.915 0.941 0.824 CB 1.534 18 residues pruned to eliminate duplicates V: 33 51.272 2.440 1.141 0.615 0.875 0.625 CB 1.778 16 residues pruned to eliminate duplicates W: 14 42.991 2.379 1.226 0.908 0.923 0.846 CA 1.732 14 residues pruned to eliminate duplicates X: 13 50.795 2.481 1.192 0.895 1.000 0.750 CB 1.934 13 residues pruned to eliminate duplicates Y: 32 61.488 2.456 1.270 0.672 0.935 0.677 CB 1.807 30 residues pruned to eliminate duplicates Z: 15 34.683 2.200 1.019 0.823 0.929 0.571 CA 1.699 15 residues pruned to eliminate duplicates Z: 16 40.325 2.270 1.086 0.920 1.000 0.667 CA 1.549 Z: 16 33.227 2.405 0.957 0.814 0.867 0.667 CB 1.601 16 residues pruned to eliminate duplicates Z: 14 41.385 2.428 0.798 0.912 1.000 0.769 CA 1.862 14 residues pruned to eliminate duplicates Z: 14 45.633 2.405 1.109 0.928 1.000 0.846 CA 1.747 14 residues pruned to eliminate duplicates Z: 13 30.853 2.491 0.744 0.898 0.917 0.917 CA 1.600 13 residues pruned to eliminate duplicates Z: 16 48.040 2.401 1.274 0.918 0.933 0.600 CA 1.717 Z: 12 43.959 2.514 1.140 0.911 0.909 0.727 CA 1.922 13 residues pruned to eliminate duplicates Z: 13 46.230 2.578 0.908 0.928 1.000 0.750 CA 1.900 13 residues pruned to eliminate duplicates Z: 14 39.980 2.348 0.953 0.880 0.923 0.692 CA 1.899 14 residues pruned to eliminate duplicates Z: 15 39.340 2.331 1.069 0.843 0.929 0.643 CB 1.748 15 residues pruned to eliminate duplicates Z: 88 70.744 2.423 0.872 0.538 0.920 0.586 CB 1.752 53 residues pruned to eliminate duplicates Z: 14 33.574 2.371 1.002 0.866 0.846 0.692 CB 1.698 14 residues pruned to eliminate duplicates Z: 116 74.139 2.321 0.970 0.544 0.913 0.617 CB 1.586 89 residues pruned to eliminate duplicates Z: 17 41.435 2.352 0.869 0.932 1.000 0.812 CB 1.645 17 residues pruned to eliminate duplicates Z: 17 36.175 2.318 0.988 0.801 0.938 0.625 CA 1.609 17 residues pruned to eliminate duplicates Z: 18 42.926 2.298 1.097 0.913 0.941 0.824 CB 1.625 18 residues pruned to eliminate duplicates Z: 15 53.831 2.440 1.259 0.949 1.000 0.929 CA 1.802 16 residues pruned to eliminate duplicates Z: 16 47.783 2.434 1.097 0.952 1.000 0.933 CB 1.665 16 residues pruned to eliminate duplicates Z: 17 37.779 2.387 1.051 0.758 0.938 0.500 CA 1.635 17 residues pruned to eliminate duplicates Z: 19 32.427 2.078 0.737 0.903 1.000 0.944 CB 1.509 17 residues pruned to eliminate duplicates Z: 15 25.989 2.466 0.802 0.793 0.714 0.571 CA 1.693 15 residues pruned to eliminate duplicates Z: 63 79.805 2.431 1.125 0.630 0.952 0.677 CA 1.825 32 residues pruned to eliminate duplicates Z: 10 23.416 2.328 0.566 0.909 1.000 0.778 CB 1.520 Z: 36 54.749 2.350 1.068 0.705 0.914 0.629 CA 1.728 31 residues pruned to eliminate duplicates Z: 13 49.469 2.444 1.256 0.925 1.000 0.833 CA 1.818 13 residues pruned to eliminate duplicates Z: 17 42.421 2.365 1.039 0.918 1.000 0.875 CB 1.551 17 residues pruned to eliminate duplicates Z: 85 67.089 2.377 0.791 0.625 0.940 0.595 CB 1.626 32 residues pruned to eliminate duplicates Z: 14 44.885 2.373 1.169 0.889 0.923 0.615 CA 1.886 14 residues pruned to eliminate duplicates Z: 13 49.293 2.490 1.207 0.901 1.000 0.917 CA 1.848 13 residues pruned to eliminate duplicates Z: 15 47.480 2.435 1.013 0.936 1.000 0.857 CA 1.804 15 residues pruned to eliminate duplicates Z: 13 33.961 2.413 0.912 0.838 0.917 0.750 CA 1.733 13 residues pruned to eliminate duplicates Z: 16 39.798 2.368 0.803 0.867 1.000 0.667 CB 1.760 Z: 16 32.179 2.141 1.189 0.869 0.867 0.533 CB 1.493 Z: 124 86.473 2.401 0.907 0.598 0.902 0.618 CB 1.718 125 residues pruned to eliminate duplicates Z: 13 29.556 2.333 0.858 0.909 0.833 0.750 CB 1.677 Z: 13 36.401 2.268 0.993 0.910 1.000 0.750 CA 1.649 13 residues pruned to eliminate duplicates Z: 68 60.831 2.242 0.968 0.624 0.925 0.672 CB 1.619 64 residues pruned to eliminate duplicates Z: 16 49.980 2.385 1.291 0.942 1.000 0.867 CB 1.639 16 residues pruned to eliminate duplicates Z: 169 83.673 2.303 0.802 0.557 0.923 0.625 CB 1.595 169 residues pruned to eliminate duplicates Z: 13 48.150 2.527 1.396 0.889 0.917 0.667 CA 1.803 13 residues pruned to eliminate duplicates Z: 18 36.816 2.223 0.781 0.916 1.000 0.765 CB 1.593 17 residues pruned to eliminate duplicates Z: 15 26.542 2.264 0.685 0.886 0.929 0.857 CA 1.445 15 residues pruned to eliminate duplicates Z: 18 40.813 2.229 1.169 0.869 0.941 0.824 CB 1.590 18 residues pruned to eliminate duplicates Z: 11 24.575 2.083 1.037 0.813 0.900 0.800 CA 1.549 11 residues pruned to eliminate duplicates Z: 10 26.363 2.205 1.197 0.782 1.000 0.667 CA 1.415 10 residues pruned to eliminate duplicates Z: 39 43.611 2.252 0.792 0.667 0.895 0.605 CA 1.679 39 residues pruned to eliminate duplicates Z: 31 45.161 2.415 0.991 0.581 0.933 0.500 CB 1.699 31 residues pruned to eliminate duplicates Z: 15 38.918 2.331 0.839 0.869 1.000 0.643 CA 1.772 15 residues pruned to eliminate duplicates Z: 12 53.298 2.655 1.383 0.916 0.909 0.727 CB 1.973 12 residues pruned to eliminate duplicates Z: 17 38.112 2.285 0.636 0.940 1.000 0.875 CA 1.770 17 residues pruned to eliminate duplicates Z: 16 45.243 2.316 1.073 0.949 1.000 0.800 CB 1.679 16 residues pruned to eliminate duplicates Z: 12 50.105 2.656 1.144 0.917 0.909 0.818 CA 2.060 12 residues pruned to eliminate duplicates Z: 23 36.002 2.296 1.092 0.523 0.955 0.591 CA 1.635 25 residues pruned to eliminate duplicates Z: 13 33.243 2.274 0.655 0.905 1.000 0.917 CB 1.815 12 residues pruned to eliminate duplicates Z: 92 71.895 2.273 1.003 0.614 0.934 0.637 CB 1.590 32 residues pruned to eliminate duplicates Z: 10 26.566 2.218 1.004 0.810 1.000 0.889 CA 1.520 10 residues pruned to eliminate duplicates Z: 19 45.501 2.222 1.282 0.915 1.000 0.556 CB 1.495 19 residues pruned to eliminate duplicates Z: 10 15.240 2.102 0.776 0.707 0.778 0.556 CB 1.449 10 residues pruned to eliminate duplicates Z: 89 76.542 2.326 1.055 0.650 0.898 0.557 CB 1.653 92 residues pruned to eliminate duplicates Z: 13 19.910 2.064 0.562 0.767 0.917 0.750 CB 1.535 Z: 14 45.688 2.380 1.212 0.912 0.923 0.846 CA 1.846 14 residues pruned to eliminate duplicates Z: 16 42.036 2.290 1.025 0.885 1.000 0.867 CB 1.691 16 residues pruned to eliminate duplicates Z: 88 83.848 2.340 1.078 0.661 0.943 0.690 CB 1.689 89 residues pruned to eliminate duplicates Z: 10 19.641 2.203 0.721 0.818 0.889 0.667 CA 1.474 10 residues pruned to eliminate duplicates Z: 14 29.464 2.348 1.070 0.904 0.769 0.615 CA 1.556 14 residues pruned to eliminate duplicates Z: 16 37.497 2.342 0.937 0.842 0.933 0.600 CB 1.703 16 residues pruned to eliminate duplicates Z: 10 20.580 2.048 0.563 0.882 1.000 0.778 CB 1.551 Z: 16 45.237 2.378 1.102 0.892 1.000 0.600 CB 1.679 17 residues pruned to eliminate duplicates Z: 11 16.015 2.120 0.382 0.867 1.000 0.700 CB 1.264 11 residues pruned to eliminate duplicates Z: 13 39.351 2.422 0.907 0.924 0.917 0.917 CA 1.884 13 residues pruned to eliminate duplicates Z: 38 32.487 2.170 0.813 0.552 0.865 0.541 CB 1.492 30 residues pruned to eliminate duplicates Z: 12 33.704 2.291 0.893 0.922 1.000 0.727 CB 1.647 12 residues pruned to eliminate duplicates Z: 73 73.517 2.333 1.022 0.675 0.944 0.611 CB 1.654 73 residues pruned to eliminate duplicates Z: 14 44.999 2.298 1.578 0.885 0.923 0.538 CA 1.648 14 residues pruned to eliminate duplicates Z: 20 25.179 2.260 0.726 0.552 0.947 0.632 CB 1.486 11 residues pruned to eliminate duplicates Z: 31 38.757 2.437 0.733 0.567 0.900 0.633 CB 1.744 22 residues pruned to eliminate duplicates Z: 147 88.512 2.358 0.905 0.598 0.918 0.596 CB 1.619 147 residues pruned to eliminate duplicates Z: 124 90.649 2.405 0.935 0.603 0.919 0.650 CB 1.734 127 residues pruned to eliminate duplicates Z: 16 32.322 2.063 1.246 0.817 0.933 0.533 CB 1.465 16 residues pruned to eliminate duplicates Z: 142 92.670 2.375 0.962 0.605 0.922 0.624 CB 1.644 142 residues pruned to eliminate duplicates Z: 15 22.731 2.102 0.469 0.912 1.000 0.857 CA 1.394 Z: 17 43.993 2.282 1.044 0.885 1.000 0.812 CB 1.702 17 residues pruned to eliminate duplicates Z: 10 22.036 2.353 0.594 0.825 0.778 0.444 CA 1.901 10 residues pruned to eliminate duplicates Z: 17 44.827 2.186 1.146 0.898 1.000 0.812 CB 1.709 17 residues pruned to eliminate duplicates Z: 14 32.104 2.185 0.929 0.912 1.000 0.846 CB 1.496 14 residues pruned to eliminate duplicates Z: 17 45.101 2.220 1.125 0.892 1.000 0.812 CB 1.717 17 residues pruned to eliminate duplicates Z: 16 44.122 2.355 1.029 0.919 1.000 0.800 CA 1.680 15 residues pruned to eliminate duplicates Z: 85 78.804 2.367 1.069 0.646 0.929 0.595 CB 1.649 82 residues pruned to eliminate duplicates Z: 16 31.589 2.164 0.896 0.827 1.000 0.600 CA 1.499 16 residues pruned to eliminate duplicates Z: 8 13.220 2.030 0.757 0.524 0.857 0.571 CA 1.596 Z: 13 39.039 2.422 1.040 0.890 0.917 0.833 CB 1.790 13 residues pruned to eliminate duplicates Z: 86 58.530 2.271 0.796 0.508 0.953 0.600 CB 1.620 80 residues pruned to eliminate duplicates Z: 16 37.220 2.136 1.064 0.933 1.000 0.333 CA 1.521 16 residues pruned to eliminate duplicates Z: 10 22.485 2.054 0.794 0.877 1.000 0.444 CB 1.477 10 residues pruned to eliminate duplicates Z: 17 35.529 2.078 1.138 0.931 0.938 0.562 CA 1.490 17 residues pruned to eliminate duplicates Z: 92 89.829 2.422 1.069 0.637 0.934 0.571 CB 1.770 94 residues pruned to eliminate duplicates Z: 10 22.308 2.159 0.532 0.875 1.000 1.000 CB 1.635 10 residues pruned to eliminate duplicates Z: 18 31.942 2.219 0.578 0.906 1.000 0.706 CB 1.573 18 residues pruned to eliminate duplicates Z: 11 13.997 2.109 0.011 0.871 1.000 0.800 CA 1.515 11 residues pruned to eliminate duplicates Z: 82 79.368 2.353 1.088 0.660 0.914 0.679 CB 1.693 82 residues pruned to eliminate duplicates Z: 16 43.330 2.332 1.125 0.890 1.000 0.800 CB 1.623 Z: 16 19.088 2.003 0.464 0.811 0.933 0.667 CB 1.373 16 residues pruned to eliminate duplicates Z: 73 57.532 2.331 1.018 0.517 0.903 0.611 CB 1.569 73 residues pruned to eliminate duplicates Z: 12 56.946 2.682 1.260 0.926 1.000 0.818 CA 1.986 12 residues pruned to eliminate duplicates Z: 73 63.876 2.335 0.850 0.620 0.958 0.667 CB 1.623 78 residues pruned to eliminate duplicates Z: 13 28.880 2.328 0.848 0.905 0.917 0.667 CB 1.504 13 residues pruned to eliminate duplicates Z: 15 20.083 2.261 0.970 0.421 0.786 0.429 CB 1.665 15 residues pruned to eliminate duplicates Z: 71 64.395 2.202 0.953 0.640 0.971 0.643 CB 1.617 16 residues pruned to eliminate duplicates Z: 10 20.152 1.995 0.845 0.828 1.000 0.778 CB 1.374 10 residues pruned to eliminate duplicates Z: 132 86.926 2.272 1.022 0.584 0.924 0.588 CB 1.652 91 residues pruned to eliminate duplicates Z: 16 23.598 2.343 0.782 0.622 0.867 0.667 CB 1.501 16 residues pruned to eliminate duplicates Z: 11 20.332 1.893 1.181 0.723 0.900 0.700 CA 1.415 11 residues pruned to eliminate duplicates Z: 10 28.152 2.331 0.667 0.918 1.000 1.000 CA 1.704 10 residues pruned to eliminate duplicates Z: 17 28.691 2.010 0.789 0.889 0.938 0.688 CA 1.532 Z: 16 32.659 2.187 0.852 0.916 1.000 0.933 CB 1.470 16 residues pruned to eliminate duplicates Z: 63 72.906 2.425 1.104 0.598 0.919 0.710 CA 1.797 63 residues pruned to eliminate duplicates Z: 16 47.207 2.409 1.003 0.947 1.000 0.933 CA 1.746 16 residues pruned to eliminate duplicates Z: 10 27.123 2.325 0.649 0.915 1.000 1.000 CA 1.666 10 residues pruned to eliminate duplicates Z: 152 86.015 2.347 0.889 0.571 0.914 0.596 CB 1.614 152 residues pruned to eliminate duplicates Z: 93 66.112 2.313 0.840 0.546 0.913 0.652 CB 1.695 85 residues pruned to eliminate duplicates Z: 11 10.844 1.869 0.241 0.665 1.000 0.500 CA 1.269 11 residues pruned to eliminate duplicates Z: 18 46.562 2.230 1.313 0.852 1.000 0.588 CB 1.619 18 residues pruned to eliminate duplicates Z: 13 47.810 2.567 1.051 0.931 1.000 0.833 CA 1.832 13 residues pruned to eliminate duplicates Z: 14 19.979 2.143 0.230 0.928 1.000 0.923 CA 1.472 14 residues pruned to eliminate duplicates Z: 17 41.122 2.217 1.020 0.884 0.938 0.750 CB 1.770 17 residues pruned to eliminate duplicates Z: 16 22.075 2.146 0.651 0.770 0.933 0.733 CB 1.357 16 residues pruned to eliminate duplicates Z: 10 16.789 2.123 0.504 0.728 1.000 0.667 CA 1.427 10 residues pruned to eliminate duplicates Z: 10 13.016 2.030 1.104 0.647 0.778 0.667 CB 1.138 9 residues pruned to eliminate duplicates Z: 17 47.381 2.287 1.168 0.943 1.000 0.750 CB 1.656 17 residues pruned to eliminate duplicates Z: 11 19.870 2.112 0.564 0.839 1.000 0.900 CB 1.421 12 residues pruned to eliminate duplicates Z: 13 25.805 2.217 0.824 0.888 0.833 0.667 CB 1.592 13 residues pruned to eliminate duplicates Z: 11 20.278 1.963 0.825 0.784 0.900 0.700 CA 1.549 11 residues pruned to eliminate duplicates Z: 85 78.794 2.338 1.015 0.621 0.952 0.619 CB 1.709 85 residues pruned to eliminate duplicates Z: 16 23.409 2.041 0.866 0.799 0.867 0.667 CB 1.410 16 residues pruned to eliminate duplicates Z: 19 16.432 2.163 0.680 0.471 0.778 0.667 CB 1.412 19 residues pruned to eliminate duplicates Z: 16 57.015 2.416 1.270 0.945 1.000 0.733 CB 1.857 16 residues pruned to eliminate duplicates Z: 71 72.715 2.359 1.117 0.634 0.900 0.629 CB 1.705 71 residues pruned to eliminate duplicates Z: 72 68.619 2.242 0.978 0.647 0.944 0.634 CB 1.697 71 residues pruned to eliminate duplicates Z: 109 86.835 2.349 0.935 0.644 0.944 0.620 CB 1.702 109 residues pruned to eliminate duplicates Z: 16 41.749 2.325 0.981 0.875 1.000 0.467 CB 1.703 16 residues pruned to eliminate duplicates Z: 18 31.819 2.239 1.214 0.539 0.882 0.588 CB 1.699 18 residues pruned to eliminate duplicates Z: 12 18.780 2.117 0.492 0.757 1.000 0.636 CA 1.427 12 residues pruned to eliminate duplicates Z: 13 36.433 2.278 0.891 0.904 1.000 0.667 CA 1.740 13 residues pruned to eliminate duplicates Z: 6 11.426 2.123 0.385 0.643 1.000 0.200 CA 1.521 6 residues pruned to eliminate duplicates Z: 8 7.366 1.993 -0.062 0.796 0.857 0.714 CA 1.340 8 residues pruned to eliminate duplicates Z: 15 47.768 2.412 0.997 0.938 1.000 1.000 CA 1.843 15 residues pruned to eliminate duplicates Z: 167 91.831 2.329 0.890 0.564 0.928 0.645 CB 1.640 167 residues pruned to eliminate duplicates Z: 12 17.787 1.910 0.814 0.791 0.909 0.636 CB 1.319 12 residues pruned to eliminate duplicates Z: 12 12.969 1.685 0.877 0.810 0.909 0.909 CB 1.038 12 residues pruned to eliminate duplicates Z: 15 14.363 1.984 0.459 0.423 0.929 0.643 CA 1.548 15 residues pruned to eliminate duplicates Z: 17 42.916 2.292 0.957 0.897 1.000 0.750 CB 1.712 17 residues pruned to eliminate duplicates Z: 16 32.235 2.105 1.093 0.876 0.933 0.733 CA 1.471 16 residues pruned to eliminate duplicates Z: 14 35.251 2.331 0.929 0.873 1.000 0.846 CA 1.583 14 residues pruned to eliminate duplicates Z: 12 13.997 1.859 0.522 0.846 0.909 0.818 CA 1.220 Z: 16 34.919 2.102 1.186 0.924 0.933 0.733 CB 1.477 16 residues pruned to eliminate duplicates Z: 18 41.154 2.112 1.011 0.938 1.000 0.882 CA 1.634 18 residues pruned to eliminate duplicates Z: 9 29.822 2.375 0.765 0.922 1.000 0.875 CB 1.769 9 residues pruned to eliminate duplicates Z: 52 28.399 1.969 0.755 0.459 0.882 0.588 CB 1.360 43 residues pruned to eliminate duplicates Z: 146 75.628 2.190 0.774 0.579 0.924 0.648 CB 1.622 89 residues pruned to eliminate duplicates Z: 60 67.870 2.408 1.029 0.594 0.949 0.644 CB 1.743 60 residues pruned to eliminate duplicates Z: 17 30.222 2.016 0.955 0.897 0.938 0.688 CB 1.463 17 residues pruned to eliminate duplicates Z: 16 34.177 2.190 0.959 0.925 1.000 0.733 CA 1.443 16 residues pruned to eliminate duplicates Z: 16 37.075 2.193 1.049 0.932 1.000 0.867 CB 1.488 16 residues pruned to eliminate duplicates Z: 13 48.027 2.560 1.399 0.890 0.917 0.833 CA 1.772 13 residues pruned to eliminate duplicates Z: 18 43.068 2.242 0.951 0.898 1.000 0.706 CA 1.709 18 residues pruned to eliminate duplicates Z: 230 101.888 2.286 0.857 0.573 0.917 0.607 CB 1.611 206 residues pruned to eliminate duplicates Z: 158 91.362 2.317 0.923 0.593 0.911 0.650 CB 1.645 158 residues pruned to eliminate duplicates Z: 18 34.801 2.281 1.054 0.797 0.882 0.588 CB 1.574 18 residues pruned to eliminate duplicates Z: 11 19.267 1.930 0.733 0.914 1.000 0.900 CB 1.288 10 residues pruned to eliminate duplicates Z: 231 106.240 2.289 0.870 0.574 0.930 0.600 CB 1.637 230 residues pruned to eliminate duplicates Z: 74 48.263 2.252 0.779 0.528 0.877 0.616 CB 1.565 74 residues pruned to eliminate duplicates Z: 18 44.916 2.234 1.066 0.909 1.000 0.765 CA 1.675 18 residues pruned to eliminate duplicates Z: 62 55.718 2.340 0.936 0.577 0.918 0.672 CB 1.593 62 residues pruned to eliminate duplicates Z: 60 63.881 2.388 1.012 0.580 0.949 0.644 CB 1.688 60 residues pruned to eliminate duplicates Z: 20 9.854 1.984 0.327 0.383 0.684 0.421 CB 1.420 20 residues pruned to eliminate duplicates Z: 11 14.725 1.912 0.523 0.897 0.900 0.700 CB 1.272 11 residues pruned to eliminate duplicates Z: 83 71.209 2.360 0.857 0.629 0.951 0.622 CB 1.671 83 residues pruned to eliminate duplicates Z: 15 41.451 2.346 1.106 0.879 0.929 0.571 CA 1.751 15 residues pruned to eliminate duplicates Z: 16 50.118 2.439 1.224 0.941 1.000 0.733 CB 1.656 16 residues pruned to eliminate duplicates Z: 16 29.762 2.202 0.686 0.913 1.000 0.867 CB 1.465 16 residues pruned to eliminate duplicates Z: 16 51.841 2.400 1.256 0.939 1.000 0.867 CA 1.718 16 residues pruned to eliminate duplicates Z: 11 16.827 2.094 0.522 0.845 0.900 0.800 CA 1.379 13 residues pruned to eliminate duplicates Z: 9 28.212 2.315 1.113 0.908 0.875 0.875 CA 1.655 9 residues pruned to eliminate duplicates Z: 94 61.350 2.229 0.889 0.564 0.882 0.602 CB 1.610 94 residues pruned to eliminate duplicates Z: 17 50.341 2.353 1.275 0.932 1.000 0.812 CB 1.642 17 residues pruned to eliminate duplicates Z: 203 105.524 2.288 0.932 0.589 0.960 0.569 CB 1.606 206 residues pruned to eliminate duplicates Z: 91 81.382 2.413 0.995 0.577 0.922 0.611 CB 1.794 91 residues pruned to eliminate duplicates Z: 158 89.141 2.314 0.814 0.602 0.936 0.618 CB 1.643 158 residues pruned to eliminate duplicates Z: 10 25.043 2.048 1.400 0.766 0.889 0.667 CA 1.510 10 residues pruned to eliminate duplicates Z: 11 18.890 1.922 0.671 0.930 1.000 0.700 CB 1.301 11 residues pruned to eliminate duplicates Z: 16 38.149 2.326 0.784 0.906 1.000 0.800 CB 1.689 16 residues pruned to eliminate duplicates Z: 15 26.684 2.164 0.899 0.851 0.857 0.714 CB 1.499 15 residues pruned to eliminate duplicates Z: 16 30.674 2.199 0.876 0.936 0.933 0.867 CB 1.433 16 residues pruned to eliminate duplicates Z: 16 52.621 2.357 1.335 0.919 1.000 0.667 CB 1.739 16 residues pruned to eliminate duplicates Z: 15 29.752 2.024 1.247 0.861 0.929 0.643 CB 1.384 15 residues pruned to eliminate duplicates Z: 85 77.433 2.327 0.980 0.643 0.940 0.595 CB 1.705 88 residues pruned to eliminate duplicates Z: 86 65.811 2.342 0.839 0.616 0.894 0.624 CB 1.661 86 residues pruned to eliminate duplicates Z: 13 23.400 2.333 0.564 0.900 0.917 0.667 CB 1.443 13 residues pruned to eliminate duplicates Z: 14 34.355 2.137 1.071 0.891 0.923 0.769 CB 1.677 14 residues pruned to eliminate duplicates Z: 10 4.507 1.710 -0.045 0.446 0.778 0.444 CB 1.252 Z: 16 28.542 2.201 0.629 0.899 1.000 0.867 CA 1.469 16 residues pruned to eliminate duplicates Z: 17 24.682 2.021 0.576 0.840 0.938 0.812 CB 1.542 17 residues pruned to eliminate duplicates Z: 16 58.476 2.420 1.412 0.944 1.000 0.533 CA 1.791 16 residues pruned to eliminate duplicates Z: 9 27.888 2.353 0.741 0.908 1.000 0.875 CB 1.710 9 residues pruned to eliminate duplicates Z: 12 17.831 2.052 0.372 0.785 1.000 0.636 CA 1.486 12 residues pruned to eliminate duplicates Z: 14 25.568 2.187 0.580 0.899 1.000 0.692 CA 1.466 14 residues pruned to eliminate duplicates Z: 6 3.994 2.060 0.236 0.282 0.600 0.400 CB 1.496 6 residues pruned to eliminate duplicates Z: 14 32.736 2.399 0.892 0.893 0.923 0.615 CA 1.556 14 residues pruned to eliminate duplicates Z: 92 86.659 2.391 1.092 0.624 0.934 0.549 CB 1.730 92 residues pruned to eliminate duplicates Z: 112 58.442 2.091 0.792 0.558 0.901 0.586 CB 1.554 112 residues pruned to eliminate duplicates Z: 19 19.968 2.081 0.798 0.491 0.889 0.500 CB 1.429 19 residues pruned to eliminate duplicates Z: 16 26.390 2.096 0.699 0.870 0.933 0.800 CA 1.497 16 residues pruned to eliminate duplicates Z: 18 14.968 1.891 0.691 0.421 0.941 0.529 CB 1.310 Z: 70 57.353 2.333 0.943 0.541 0.928 0.536 CB 1.578 70 residues pruned to eliminate duplicates Z: 22 34.661 2.445 1.023 0.683 0.857 0.714 CB 1.508 22 residues pruned to eliminate duplicates Z: 10 16.171 1.968 1.125 0.642 1.000 0.667 CB 1.129 4 residues pruned to eliminate duplicates Z: 10 22.726 2.175 0.793 0.812 1.000 0.556 CA 1.481 10 residues pruned to eliminate duplicates Z: 14 17.732 1.892 0.986 0.650 0.923 0.615 CB 1.233 12 residues pruned to eliminate duplicates Z: 18 13.876 1.993 0.651 0.432 0.882 0.471 CB 1.243 19 residues pruned to eliminate duplicates Z: 17 26.201 2.117 0.975 0.599 0.938 0.688 CB 1.520 17 residues pruned to eliminate duplicates Z: 69 64.776 2.273 0.955 0.658 0.882 0.603 CB 1.730 69 residues pruned to eliminate duplicates Z: 72 66.618 2.236 0.911 0.626 0.972 0.648 CB 1.692 72 residues pruned to eliminate duplicates Z: 17 34.011 2.069 1.007 0.921 1.000 0.750 CA 1.440 17 residues pruned to eliminate duplicates Z: 43 21.886 1.988 0.621 0.393 0.810 0.500 CB 1.450 43 residues pruned to eliminate duplicates Z: 10 16.161 2.022 0.634 0.858 0.889 0.778 CB 1.351 11 residues pruned to eliminate duplicates Z: 11 18.480 1.955 0.421 0.921 1.000 0.900 CB 1.481 11 residues pruned to eliminate duplicates Z: 88 70.993 2.249 0.844 0.658 0.943 0.690 CB 1.682 88 residues pruned to eliminate duplicates Z: 8 8.287 1.669 0.672 0.661 1.000 0.714 CB 0.967 8 residues pruned to eliminate duplicates Z: 10 13.192 1.896 0.385 0.809 1.000 0.667 CA 1.279 10 residues pruned to eliminate duplicates Z: 87 78.782 2.419 0.978 0.610 0.907 0.581 CB 1.764 87 residues pruned to eliminate duplicates Z: 62 65.504 2.441 1.032 0.578 0.885 0.607 CB 1.771 62 residues pruned to eliminate duplicates Z: 36 52.968 2.364 0.961 0.704 0.914 0.686 CA 1.753 36 residues pruned to eliminate duplicates Z: 19 10.894 1.804 0.747 0.281 0.833 0.556 CA 1.251 19 residues pruned to eliminate duplicates Z: 15 19.089 2.001 0.523 0.897 0.929 0.714 CA 1.291 15 residues pruned to eliminate duplicates Z: 15 44.841 2.438 1.132 0.923 1.000 0.571 CB 1.620 15 residues pruned to eliminate duplicates Z: 13 21.187 1.946 0.653 0.890 0.917 0.417 CB 1.492 13 residues pruned to eliminate duplicates Z: 16 33.216 2.066 0.959 0.907 1.000 0.733 CB 1.506 16 residues pruned to eliminate duplicates Z: 85 74.144 2.374 0.854 0.641 0.964 0.667 CB 1.670 85 residues pruned to eliminate duplicates Z: 21 16.311 1.782 0.569 0.772 0.800 0.650 CA 1.282 21 residues pruned to eliminate duplicates Z: 9 20.353 2.194 0.716 0.716 1.000 0.750 CA 1.572 9 residues pruned to eliminate duplicates Z: 103 81.888 2.268 0.988 0.652 0.951 0.657 CB 1.641 103 residues pruned to eliminate duplicates Z: 18 13.649 1.871 0.375 0.517 0.882 0.471 CB 1.434 18 residues pruned to eliminate duplicates Z: 10 22.472 2.259 0.767 0.880 0.889 0.889 CB 1.530 10 residues pruned to eliminate duplicates Z: 15 24.441 2.079 0.727 0.879 1.000 0.714 CB 1.319 15 residues pruned to eliminate duplicates Z: 11 12.230 1.854 0.342 0.912 1.000 0.900 CB 1.100 Z: 13 10.848 1.847 0.538 0.361 0.917 0.417 CA 1.397 13 residues pruned to eliminate duplicates Z: 14 24.453 2.237 0.592 0.911 1.000 0.615 CB 1.350 14 residues pruned to eliminate duplicates Z: 40 41.346 2.305 0.815 0.546 0.923 0.615 CB 1.640 40 residues pruned to eliminate duplicates Z: 84 70.236 2.261 0.856 0.651 0.940 0.639 CB 1.698 84 residues pruned to eliminate duplicates Z: 37 39.568 2.282 0.907 0.472 0.917 0.556 CB 1.700 37 residues pruned to eliminate duplicates Z: 16 28.401 2.082 0.716 0.919 1.000 0.733 CB 1.447 16 residues pruned to eliminate duplicates Z: 16 37.296 2.115 1.073 0.920 1.000 0.467 CB 1.546 16 residues pruned to eliminate duplicates Z: 17 54.225 2.267 1.444 0.900 1.000 0.875 CB 1.747 17 residues pruned to eliminate duplicates Z: 55 57.703 2.240 0.888 0.666 0.944 0.648 CA 1.686 55 residues pruned to eliminate duplicates Z: 30 16.166 1.905 0.809 0.275 0.862 0.448 CB 1.303 30 residues pruned to eliminate duplicates Z: 72 52.770 2.310 0.777 0.586 0.887 0.592 CB 1.582 72 residues pruned to eliminate duplicates Z: 15 13.872 2.031 0.526 0.814 0.857 0.429 CB 1.062 15 residues pruned to eliminate duplicates Z: 16 22.900 2.363 0.611 0.731 0.800 0.400 CB 1.577 16 residues pruned to eliminate duplicates Z: 114 89.257 2.297 0.968 0.646 0.956 0.566 CB 1.696 114 residues pruned to eliminate duplicates Z: 16 25.689 2.067 0.591 0.901 0.933 0.733 CA 1.543 16 residues pruned to eliminate duplicates Z: 7 17.714 2.147 0.539 0.747 1.000 0.667 C 1.755 Z: 32 51.290 2.452 1.058 0.630 0.903 0.581 CB 1.788 32 residues pruned to eliminate duplicates Z: 13 48.256 2.474 1.449 0.894 0.917 0.750 CA 1.799 13 residues pruned to eliminate duplicates Z: 86 88.270 2.443 1.094 0.626 0.941 0.576 CB 1.767 86 residues pruned to eliminate duplicates Z: 15 26.610 2.085 0.730 0.910 1.000 0.429 CB 1.398 15 residues pruned to eliminate duplicates Z: 33 28.798 2.186 0.652 0.465 0.906 0.656 CB 1.613 33 residues pruned to eliminate duplicates Z: 18 50.773 2.260 1.284 0.927 1.000 0.647 CB 1.672 18 residues pruned to eliminate duplicates Z: 88 83.968 2.340 1.042 0.649 0.954 0.632 CB 1.718 89 residues pruned to eliminate duplicates Z: 70 62.403 2.280 0.877 0.628 0.986 0.638 CB 1.579 70 residues pruned to eliminate duplicates Z: 12 38.413 2.596 0.675 0.899 1.000 0.545 CB 1.904 12 residues pruned to eliminate duplicates Z: 10 20.118 2.168 0.812 0.744 1.000 0.556 CA 1.372 10 residues pruned to eliminate duplicates Z: 11 6.852 1.899 -0.096 0.416 0.900 0.400 CB 1.531 Z: 7 3.853 1.734 0.351 0.252 0.667 0.500 O 1.339 Z: 8 7.384 1.918 -0.205 0.600 1.000 0.571 CB 1.664 Z: 43 27.318 1.991 0.607 0.532 0.881 0.524 CB 1.449 43 residues pruned to eliminate duplicates Z: 59 65.034 2.477 0.966 0.578 0.897 0.655 CB 1.815 59 residues pruned to eliminate duplicates Z: 17 25.262 1.904 0.687 0.905 0.938 0.875 CB 1.492 17 residues pruned to eliminate duplicates Z: 13 43.085 2.405 1.197 0.908 0.917 0.833 CA 1.824 13 residues pruned to eliminate duplicates Z: 124 91.819 2.401 0.945 0.596 0.919 0.650 CB 1.760 124 residues pruned to eliminate duplicates Z: 17 38.585 2.319 1.123 0.899 0.938 0.438 CB 1.494 17 residues pruned to eliminate duplicates Z: 16 41.318 2.347 1.061 0.911 0.933 0.667 CB 1.675 16 residues pruned to eliminate duplicates Z: 17 21.931 2.077 0.473 0.914 0.938 0.750 CA 1.352 17 residues pruned to eliminate duplicates Z: 15 33.855 2.199 1.010 0.936 1.000 0.929 CB 1.426 15 residues pruned to eliminate duplicates Z: 32 52.521 2.431 1.066 0.643 0.935 0.548 CB 1.757 32 residues pruned to eliminate duplicates Z: 31 21.072 1.992 0.877 0.345 0.867 0.600 CA 1.405 32 residues pruned to eliminate duplicates Z: 16 30.083 2.102 0.664 0.904 1.000 0.667 CB 1.582 16 residues pruned to eliminate duplicates Z: 14 20.635 2.054 0.881 0.933 1.000 0.923 CB 1.033 14 residues pruned to eliminate duplicates Z: 11 18.160 1.942 0.686 0.768 1.000 0.600 CA 1.384 11 residues pruned to eliminate duplicates Z: 15 33.274 2.411 0.577 0.911 1.000 0.714 CB 1.658 15 residues pruned to eliminate duplicates Z: 85 76.335 2.334 0.892 0.624 0.976 0.655 CB 1.719 85 residues pruned to eliminate duplicates Z: 14 28.059 2.387 0.631 0.889 0.923 0.769 CA 1.560 14 residues pruned to eliminate duplicates Z: 118 82.838 2.291 0.956 0.627 0.932 0.547 CB 1.628 118 residues pruned to eliminate duplicates Z: 8 15.051 2.081 0.592 0.873 0.857 0.714 CA 1.460 8 residues pruned to eliminate duplicates Z: 90 65.864 2.233 0.814 0.613 0.933 0.596 CB 1.661 90 residues pruned to eliminate duplicates Z: 14 13.426 1.673 0.819 0.703 0.769 0.615 CA 1.322 14 residues pruned to eliminate duplicates Z: 24 23.927 2.189 0.873 0.478 0.783 0.565 CB 1.589 24 residues pruned to eliminate duplicates Z: 14 13.550 1.768 0.602 0.404 1.000 0.692 CA 1.467 14 residues pruned to eliminate duplicates Z: 13 25.641 2.288 0.509 0.928 1.000 0.917 CA 1.501 13 residues pruned to eliminate duplicates Z: 22 11.946 1.953 0.668 0.335 0.714 0.524 CB 1.342 22 residues pruned to eliminate duplicates Z: 11 13.070 1.952 0.739 0.671 0.900 0.400 CB 1.155 11 residues pruned to eliminate duplicates Z: 15 30.383 2.095 1.128 0.892 0.929 0.500 CB 1.409 15 residues pruned to eliminate duplicates Z: 70 60.645 2.337 0.831 0.605 0.942 0.652 CB 1.639 70 residues pruned to eliminate duplicates Z: 15 22.486 2.040 0.437 0.913 0.929 0.929 CA 1.563 15 residues pruned to eliminate duplicates Z: 15 23.044 2.093 0.391 0.935 1.000 0.786 CA 1.473 15 residues pruned to eliminate duplicates Z: 14 28.685 2.256 0.963 0.828 1.000 0.846 CA 1.353 14 residues pruned to eliminate duplicates Z: 15 34.167 2.216 0.884 0.913 1.000 0.786 CA 1.547 15 residues pruned to eliminate duplicates Z: 25 19.378 1.932 0.650 0.432 0.833 0.375 CB 1.598 25 residues pruned to eliminate duplicates Z: 12 23.084 2.303 0.532 0.918 0.909 0.727 CA 1.530 12 residues pruned to eliminate duplicates Z: 90 69.374 2.212 0.878 0.655 0.944 0.629 CB 1.624 90 residues pruned to eliminate duplicates Z: 16 29.401 2.176 0.619 0.888 1.000 0.733 CA 1.552 16 residues pruned to eliminate duplicates Z: 12 18.601 1.910 0.947 0.780 0.909 0.455 CB 1.297 12 residues pruned to eliminate duplicates Z: 15 25.406 2.200 0.683 0.853 0.857 0.571 CB 1.581 15 residues pruned to eliminate duplicates Z: 17 18.293 1.755 0.614 0.850 0.938 0.812 CA 1.277 17 residues pruned to eliminate duplicates Z: 19 23.901 1.926 0.740 0.787 0.889 0.722 CA 1.470 19 residues pruned to eliminate duplicates Z: 24 39.094 2.498 0.986 0.577 0.913 0.652 CA 1.672 24 residues pruned to eliminate duplicates Z: 9 2.849 1.850 -0.307 0.507 0.750 0.375 CB 1.041 9 residues pruned to eliminate duplicates Z: 11 3.497 1.562 0.208 0.424 0.700 0.500 CB 0.906 Z: 28 22.557 1.995 0.949 0.611 0.963 0.593 CB 1.043 147 residues pruned to eliminate duplicates Z: 170 87.113 2.323 0.906 0.565 0.888 0.615 CB 1.602 170 residues pruned to eliminate duplicates Z: 35 17.855 1.938 0.606 0.450 0.853 0.559 CB 1.213 23 residues pruned to eliminate duplicates Z: 17 48.908 2.295 1.241 0.927 1.000 0.625 CB 1.666 17 residues pruned to eliminate duplicates Z: 13 43.725 2.438 1.202 0.879 0.917 0.583 CA 1.860 13 residues pruned to eliminate duplicates Z: 13 19.917 2.135 0.732 0.481 1.000 0.750 CB 1.585 13 residues pruned to eliminate duplicates Z: 9 13.714 1.846 0.476 0.918 1.000 1.000 CB 1.255 Z: 14 15.307 1.982 0.674 0.377 0.923 0.538 CB 1.580 14 residues pruned to eliminate duplicates Z: 83 67.496 2.248 0.890 0.623 0.939 0.646 CB 1.663 83 residues pruned to eliminate duplicates Z: 10 22.238 2.050 0.714 0.898 1.000 0.556 CB 1.509 10 residues pruned to eliminate duplicates Z: 121 84.809 2.248 0.962 0.633 0.942 0.617 CB 1.646 121 residues pruned to eliminate duplicates Z: 15 23.338 2.253 0.922 0.535 1.000 0.714 CB 1.391 15 residues pruned to eliminate duplicates Z: 16 31.090 2.101 0.740 0.908 1.000 0.867 CB 1.560 16 residues pruned to eliminate duplicates Z: 16 24.277 2.155 0.446 0.896 1.000 0.733 CA 1.441 16 residues pruned to eliminate duplicates Z: 26 19.637 1.954 0.375 0.552 0.960 0.680 CB 1.448 26 residues pruned to eliminate duplicates Z: 10 17.567 1.908 0.794 0.825 1.000 0.667 CA 1.292 10 residues pruned to eliminate duplicates Z: 10 18.077 2.060 0.408 0.854 1.000 0.889 CB 1.534 10 residues pruned to eliminate duplicates Z: 20 12.870 2.079 0.540 0.283 0.842 0.579 CA 1.399 Z: 10 16.431 2.116 0.815 0.769 0.778 0.444 CB 1.445 10 residues pruned to eliminate duplicates Z: 16 31.624 2.193 0.761 0.933 1.000 0.800 CA 1.475 16 residues pruned to eliminate duplicates Z: 10 7.201 1.550 0.263 0.852 0.778 0.778 CB 1.166 Z: 14 37.456 2.331 1.017 0.907 0.923 0.846 CA 1.701 14 residues pruned to eliminate duplicates Z: 27 20.357 1.980 1.011 0.359 0.885 0.654 CB 1.319 27 residues pruned to eliminate duplicates Z: 16 22.878 2.084 0.821 0.860 0.933 0.933 CB 1.227 16 residues pruned to eliminate duplicates Z: 6 3.477 1.775 0.068 0.391 0.800 0.800 N 1.150 4 residues pruned to eliminate duplicates Z: 17 32.353 1.966 0.834 0.938 1.000 0.625 CA 1.560 17 residues pruned to eliminate duplicates Z: 14 12.602 2.036 0.524 0.460 0.846 0.538 CA 1.386 14 residues pruned to eliminate duplicates Z: 55 30.338 2.156 0.599 0.391 0.889 0.574 CB 1.512 55 residues pruned to eliminate duplicates Z: 18 23.480 1.961 0.577 0.887 0.941 0.588 CA 1.411 18 residues pruned to eliminate duplicates Z: 14 19.630 2.124 0.341 0.939 1.000 0.769 CA 1.328 14 residues pruned to eliminate duplicates Z: 10 10.975 1.926 0.183 0.805 1.000 0.444 CB 1.230 10 residues pruned to eliminate duplicates Z: 26 37.217 2.399 0.876 0.566 0.920 0.400 CA 1.686 Z: 16 16.728 1.856 1.021 0.870 0.933 0.733 CB 0.900 16 residues pruned to eliminate duplicates Z: 15 27.348 2.137 0.854 0.895 0.929 0.786 CB 1.425 15 residues pruned to eliminate duplicates Z: 15 61.000 2.484 1.520 0.948 1.000 0.714 CB 1.799 15 residues pruned to eliminate duplicates Z: 87 70.771 2.245 0.890 0.643 0.953 0.593 CB 1.651 87 residues pruned to eliminate duplicates Z: 10 14.915 1.916 1.180 0.804 0.778 0.778 CB 1.173 10 residues pruned to eliminate duplicates Z: 7 9.794 1.836 0.676 0.693 0.833 0.833 CA 1.307 7 residues pruned to eliminate duplicates Z: 10 12.043 1.761 0.723 0.828 0.889 0.556 CB 1.121 Z: 14 38.829 2.342 0.688 0.920 1.000 0.923 CB 1.918 14 residues pruned to eliminate duplicates Z: 11 13.522 1.852 0.498 0.879 1.000 0.700 CB 1.118 11 residues pruned to eliminate duplicates Z: 114 75.690 2.266 0.837 0.609 0.912 0.619 CB 1.692 114 residues pruned to eliminate duplicates Z: 14 23.568 2.213 0.933 0.885 0.846 0.769 CB 1.303 14 residues pruned to eliminate duplicates Z: 14 22.586 2.206 0.621 0.870 0.923 0.615 CA 1.385 14 residues pruned to eliminate duplicates Z: 17 27.835 1.983 0.624 0.900 1.000 0.812 CB 1.543 17 residues pruned to eliminate duplicates Z: 15 33.655 2.215 0.991 0.915 0.929 0.643 CA 1.552 15 residues pruned to eliminate duplicates Z: 57 29.900 2.014 0.565 0.439 0.911 0.589 CB 1.483 57 residues pruned to eliminate duplicates Z: 17 34.228 2.284 0.746 0.866 0.938 0.562 CB 1.676 17 residues pruned to eliminate duplicates Z: 27 19.282 1.975 0.525 0.506 0.885 0.500 CA 1.412 27 residues pruned to eliminate duplicates Z: 14 34.464 2.357 0.716 0.880 0.923 0.615 CB 1.854 14 residues pruned to eliminate duplicates Z: 33 47.940 2.365 1.140 0.634 0.906 0.719 CA 1.630 Z: 8 21.376 2.287 0.783 0.880 0.857 0.714 CB 1.675 8 residues pruned to eliminate duplicates Z: 8 14.879 1.901 0.500 0.893 1.000 1.000 CB 1.416 9 residues pruned to eliminate duplicates Z: 12 17.662 1.993 0.519 0.777 1.000 0.818 CB 1.378 12 residues pruned to eliminate duplicates Z: 120 82.320 2.263 0.895 0.621 0.933 0.588 CB 1.683 120 residues pruned to eliminate duplicates Z: 14 25.160 2.090 1.089 0.943 0.923 0.769 CB 1.200 14 residues pruned to eliminate duplicates Z: 12 30.502 2.333 0.691 0.916 1.000 0.909 CB 1.647 12 residues pruned to eliminate duplicates Z: 10 13.148 1.833 0.724 0.670 1.000 0.556 CA 1.186 9 residues pruned to eliminate duplicates Z: 13 37.561 2.543 0.745 0.909 0.917 0.417 CB 1.892 13 residues pruned to eliminate duplicates Z: 7 18.340 1.959 1.516 0.642 0.833 0.833 CA 1.596 7 residues pruned to eliminate duplicates Z: 16 10.527 1.905 0.279 0.354 0.867 0.467 CB 1.505 7 residues pruned to eliminate duplicates Z: 12 21.793 2.351 0.586 0.788 0.727 0.636 CA 1.881 12 residues pruned to eliminate duplicates Z: 59 55.822 2.368 0.993 0.588 0.914 0.448 CB 1.562 59 residues pruned to eliminate duplicates Z: 40 56.371 2.343 1.109 0.681 0.923 0.410 CB 1.675 40 residues pruned to eliminate duplicates Z: 14 10.570 1.656 0.430 0.747 0.769 0.615 CB 1.290 14 residues pruned to eliminate duplicates Z: 15 31.438 2.165 1.030 0.887 0.929 0.786 CB 1.484 15 residues pruned to eliminate duplicates Z: 10 16.283 1.895 0.803 0.805 1.000 0.556 CB 1.217 10 residues pruned to eliminate duplicates Z: 15 31.547 2.232 0.809 0.934 1.000 1.000 CB 1.456 15 residues pruned to eliminate duplicates Z: 16 23.809 2.152 0.742 0.888 0.800 0.733 CB 1.477 16 residues pruned to eliminate duplicates Z: 16 26.359 2.076 0.584 0.921 1.000 0.933 CB 1.457 16 residues pruned to eliminate duplicates Z: 74 55.615 2.196 0.739 0.597 0.945 0.616 CB 1.643 74 residues pruned to eliminate duplicates Z: 80 56.917 2.296 0.850 0.525 0.899 0.544 CB 1.636 46 residues pruned to eliminate duplicates Z: 14 26.056 2.195 0.842 0.885 0.923 0.692 CB 1.398 14 residues pruned to eliminate duplicates Z: 15 32.656 2.266 0.764 0.914 1.000 0.643 CB 1.544 15 residues pruned to eliminate duplicates Z: 11 17.133 1.911 0.609 0.876 1.000 0.600 CB 1.281 11 residues pruned to eliminate duplicates Z: 14 12.802 1.883 0.020 0.870 1.000 0.923 CA 1.350 14 residues pruned to eliminate duplicates Z: 37 24.300 2.175 0.645 0.419 0.833 0.417 CB 1.478 37 residues pruned to eliminate duplicates Z: 66 52.991 2.315 0.732 0.562 0.969 0.615 CB 1.591 66 residues pruned to eliminate duplicates Z: 19 9.559 1.708 0.346 0.327 0.944 0.611 CB 1.255 19 residues pruned to eliminate duplicates Z: 9 13.584 2.088 0.897 0.292 1.000 0.750 CA 1.530 9 residues pruned to eliminate duplicates Z: 18 47.909 2.241 1.417 0.861 0.941 0.588 CB 1.675 18 residues pruned to eliminate duplicates Z: 61 31.463 2.027 0.795 0.463 0.917 0.600 CB 1.264 61 residues pruned to eliminate duplicates Z: 29 31.250 2.207 0.871 0.483 0.929 0.429 CB 1.567 29 residues pruned to eliminate duplicates Z: 11 15.330 1.763 0.842 0.915 1.000 0.700 CB 1.055 Z: 9 13.211 1.974 0.899 0.753 0.750 0.500 CA 1.326 9 residues pruned to eliminate duplicates Z: 16 32.628 2.180 0.874 0.913 0.933 0.733 CB 1.563 16 residues pruned to eliminate duplicates Z: 17 15.361 1.817 0.330 0.759 0.938 0.625 CA 1.346 17 residues pruned to eliminate duplicates Z: 7 3.740 1.582 0.669 0.556 0.833 0.500 CB 0.657 7 residues pruned to eliminate duplicates Z: 9 14.418 1.820 0.780 0.883 1.000 0.875 CB 1.137 9 residues pruned to eliminate duplicates Z: 89 71.655 2.309 0.995 0.641 0.898 0.636 CB 1.618 89 residues pruned to eliminate duplicates Z: 150 82.825 2.206 0.825 0.609 0.940 0.644 CB 1.618 159 residues pruned to eliminate duplicates Z: 10 9.693 1.860 0.556 0.814 0.889 0.889 CB 0.956 10 residues pruned to eliminate duplicates Z: 71 71.941 2.330 1.047 0.655 0.914 0.600 CB 1.707 71 residues pruned to eliminate duplicates Z: 12 15.292 1.792 0.591 0.914 1.000 0.727 CB 1.144 12 residues pruned to eliminate duplicates Z: 6 8.452 1.933 0.257 0.634 1.000 0.800 CB 1.373 6 residues pruned to eliminate duplicates Z: 67 69.410 2.498 0.957 0.575 0.924 0.621 CB 1.758 67 residues pruned to eliminate duplicates Z: 6 9.454 1.919 0.398 0.693 1.000 0.400 CA 1.322 Z: 149 82.484 2.217 0.838 0.610 0.926 0.676 CB 1.619 153 residues pruned to eliminate duplicates Z: 15 21.775 1.857 0.545 0.885 1.000 0.786 CA 1.465 15 residues pruned to eliminate duplicates Z: 77 53.906 2.147 0.776 0.623 0.895 0.579 CB 1.613 77 residues pruned to eliminate duplicates Z: 12 23.812 2.262 0.729 0.803 0.909 0.636 CA 1.549 12 residues pruned to eliminate duplicates Z: 10 13.891 2.082 0.353 0.743 1.000 0.778 CA 1.323 10 residues pruned to eliminate duplicates Z: 11 14.319 2.005 0.564 0.819 0.900 0.800 CA 1.216 11 residues pruned to eliminate duplicates Z: 114 89.378 2.371 0.945 0.648 0.947 0.699 CB 1.677 114 residues pruned to eliminate duplicates Z: 9 16.167 2.191 0.805 0.764 0.750 0.625 CA 1.525 9 residues pruned to eliminate duplicates Z: 10 16.241 2.144 0.689 0.864 0.778 0.778 CB 1.409 10 residues pruned to eliminate duplicates Z: 17 41.973 2.338 1.178 0.626 1.000 0.750 CB 1.831 17 residues pruned to eliminate duplicates Z: 14 19.340 2.024 0.826 0.928 1.000 0.769 CB 1.017 14 residues pruned to eliminate duplicates Z: 11 19.991 2.008 0.945 0.733 0.800 0.700 CB 1.640 11 residues pruned to eliminate duplicates Z: 9 2.724 1.686 0.626 0.352 0.500 0.500 CB 0.824 6 residues pruned to eliminate duplicates Z: 34 25.713 2.079 0.656 0.483 0.909 0.667 CB 1.455 34 residues pruned to eliminate duplicates Z: 13 18.664 2.232 0.413 0.766 0.833 0.667 CB 1.618 13 residues pruned to eliminate duplicates Z: 74 33.342 2.029 0.721 0.464 0.904 0.589 CB 1.282 74 residues pruned to eliminate duplicates Z: 11 15.268 1.996 0.658 0.858 0.800 0.800 CA 1.343 11 residues pruned to eliminate duplicates Z: 13 39.974 2.430 0.965 0.914 0.917 0.750 CA 1.865 13 residues pruned to eliminate duplicates Z: 14 14.050 1.856 0.233 0.872 0.923 0.846 CB 1.344 14 residues pruned to eliminate duplicates Z: 14 28.899 2.202 0.928 0.908 0.923 0.615 CB 1.453 14 residues pruned to eliminate duplicates Z: 56 31.599 2.024 0.818 0.554 0.909 0.600 CB 1.209 59 residues pruned to eliminate duplicates Z: 11 19.316 1.832 0.886 0.820 1.000 0.500 CA 1.339 11 residues pruned to eliminate duplicates Z: 119 82.139 2.276 0.883 0.631 0.915 0.644 CB 1.705 119 residues pruned to eliminate duplicates Z: 16 20.969 2.183 0.540 0.797 1.000 0.733 CA 1.242 16 residues pruned to eliminate duplicates Z: 19 41.690 2.239 1.312 0.873 0.889 0.611 CB 1.555 19 residues pruned to eliminate duplicates Z: 130 90.406 2.348 0.917 0.624 0.946 0.612 CB 1.663 130 residues pruned to eliminate duplicates Z: 9 11.056 1.868 0.654 0.841 0.750 0.375 CA 1.258 9 residues pruned to eliminate duplicates Z: 89 73.101 2.372 0.937 0.579 0.920 0.625 CB 1.707 89 residues pruned to eliminate duplicates Z: 11 17.260 2.125 0.453 0.887 0.900 0.900 CB 1.416 11 residues pruned to eliminate duplicates Z: 15 14.581 2.058 0.518 0.384 0.929 0.500 CA 1.518 21 residues pruned to eliminate duplicates Z: 82 76.746 2.354 0.910 0.642 0.975 0.679 CB 1.703 82 residues pruned to eliminate duplicates Z: 16 51.579 2.368 1.267 0.945 1.000 0.400 CB 1.717 16 residues pruned to eliminate duplicates Z: 91 75.241 2.298 0.999 0.623 0.933 0.644 CB 1.647 91 residues pruned to eliminate duplicates Z: 17 26.041 2.065 0.603 0.909 1.000 0.875 CA 1.395 17 residues pruned to eliminate duplicates Z: 14 15.460 2.014 0.534 0.564 0.923 0.769 CB 1.413 14 residues pruned to eliminate duplicates Z: 14 37.502 2.322 0.845 0.904 1.000 0.385 CA 1.729 14 residues pruned to eliminate duplicates Z: 9 5.823 1.622 -0.290 0.885 1.000 1.000 CB 1.292 8 residues pruned to eliminate duplicates Z: 43 25.471 1.974 0.771 0.525 0.905 0.595 CB 1.212 43 residues pruned to eliminate duplicates Z: 8 17.763 2.129 0.472 0.873 1.000 0.857 CA 1.561 8 residues pruned to eliminate duplicates Z: 39 30.607 1.948 0.897 0.632 0.974 0.737 CB 1.219 37 residues pruned to eliminate duplicates Z: 13 13.222 1.884 0.386 0.757 0.917 0.583 CB 1.268 13 residues pruned to eliminate duplicates Z: 38 53.748 2.301 1.168 0.682 0.865 0.595 CB 1.733 34 residues pruned to eliminate duplicates Z: 19 21.151 2.209 0.776 0.524 0.833 0.500 CA 1.490 19 residues pruned to eliminate duplicates Z: 9 11.349 1.839 0.543 0.757 0.875 0.750 CA 1.285 9 residues pruned to eliminate duplicates Z: 17 31.805 2.071 0.879 0.906 1.000 0.875 CA 1.453 17 residues pruned to eliminate duplicates Z: 15 18.815 2.006 0.698 0.915 1.000 0.929 CB 1.043 15 residues pruned to eliminate duplicates Z: 15 39.331 2.360 0.919 0.899 1.000 0.786 CA 1.659 15 residues pruned to eliminate duplicates Z: 29 40.992 2.442 0.942 0.560 0.893 0.571 CB 1.727 29 residues pruned to eliminate duplicates Z: 18 19.599 2.047 0.589 0.497 0.941 0.588 CB 1.558 10 residues pruned to eliminate duplicates Z: 101 73.238 2.268 0.879 0.588 0.950 0.570 CB 1.662 107 residues pruned to eliminate duplicates Z: 16 20.995 2.010 0.495 0.626 1.000 0.800 CB 1.602 16 residues pruned to eliminate duplicates Z: 11 14.393 1.869 0.519 0.854 1.000 0.500 CB 1.185 11 residues pruned to eliminate duplicates Z: 15 26.143 2.215 0.688 0.857 0.857 0.571 CB 1.606 15 residues pruned to eliminate duplicates Z: 17 33.373 2.020 0.956 0.895 1.000 0.750 CB 1.513 17 residues pruned to eliminate duplicates Z: 9 7.485 1.635 0.093 0.868 0.875 0.750 CB 1.236 9 residues pruned to eliminate duplicates Z: 8 10.874 1.866 0.188 0.912 1.000 1.000 CB 1.313 8 residues pruned to eliminate duplicates Z: 91 69.640 2.342 0.867 0.586 0.922 0.611 CB 1.676 91 residues pruned to eliminate duplicates Z: 17 43.459 2.344 1.181 0.926 0.938 0.562 CB 1.590 17 residues pruned to eliminate duplicates Z: 10 16.812 1.839 0.879 0.779 1.000 0.778 CB 1.267 10 residues pruned to eliminate duplicates Z: 10 6.871 1.764 -0.059 0.467 1.000 0.556 C 1.428 8 residues pruned to eliminate duplicates Z: 216 101.315 2.287 0.852 0.577 0.935 0.628 CB 1.621 216 residues pruned to eliminate duplicates Z: 15 23.711 2.109 0.500 0.875 1.000 0.714 CB 1.457 15 residues pruned to eliminate duplicates Z: 15 30.722 2.117 0.923 0.938 1.000 0.786 CB 1.402 15 residues pruned to eliminate duplicates Z: 10 14.563 2.069 0.324 0.828 1.000 0.778 CA 1.335 10 residues pruned to eliminate duplicates Z: 9 15.285 2.054 0.557 0.837 0.875 0.875 CA 1.444 9 residues pruned to eliminate duplicates Z: 15 26.216 2.043 0.674 0.913 1.000 0.571 CA 1.450 15 residues pruned to eliminate duplicates Z: 146 84.652 2.212 0.874 0.618 0.938 0.669 CB 1.618 152 residues pruned to eliminate duplicates Z: 33 22.646 2.023 0.661 0.480 0.906 0.375 CB 1.342 43 residues pruned to eliminate duplicates Z: 11 15.204 1.845 0.697 0.912 1.000 0.800 CB 1.087 11 residues pruned to eliminate duplicates Z: 8 7.229 2.095 0.347 0.826 0.571 0.429 CB 1.278 8 residues pruned to eliminate duplicates Z: 14 9.527 1.939 0.924 0.303 0.769 0.538 CA 1.146 8 residues pruned to eliminate duplicates Z: 13 23.184 2.167 0.846 0.674 0.917 0.667 CA 1.556 13 residues pruned to eliminate duplicates Z: 43 52.207 2.217 1.137 0.657 0.905 0.524 CB 1.624 41 residues pruned to eliminate duplicates Z: 82 85.812 2.461 0.979 0.636 0.938 0.642 CB 1.837 105 residues pruned to eliminate duplicates Z: 13 15.184 1.837 0.691 0.824 0.833 0.750 CA 1.279 13 residues pruned to eliminate duplicates Z: 15 31.685 2.048 0.899 0.923 1.000 0.857 CB 1.530 15 residues pruned to eliminate duplicates Z: 17 10.674 1.896 0.212 0.383 0.938 0.562 CB 1.404 17 residues pruned to eliminate duplicates Z: 11 11.278 1.859 0.367 0.877 1.000 0.600 CB 1.019 11 residues pruned to eliminate duplicates Z: 158 93.601 2.315 0.976 0.595 0.924 0.605 CB 1.614 158 residues pruned to eliminate duplicates Z: 65 54.119 2.284 0.914 0.573 0.938 0.516 CB 1.538 65 residues pruned to eliminate duplicates Z: 21 44.513 2.453 1.185 0.696 0.900 0.700 CA 1.726 21 residues pruned to eliminate duplicates Z: 42 49.370 2.244 1.116 0.606 0.878 0.634 CA 1.673 42 residues pruned to eliminate duplicates Z: 41 30.712 2.016 0.684 0.568 0.875 0.650 CA 1.531 40 residues pruned to eliminate duplicates Z: 16 14.954 1.827 0.860 0.472 0.933 0.733 CB 1.252 16 residues pruned to eliminate duplicates Z: 53 52.689 2.327 0.817 0.611 0.942 0.731 CB 1.651 53 residues pruned to eliminate duplicates Z: 10 10.613 1.652 0.327 0.813 1.000 0.889 CB 1.229 10 residues pruned to eliminate duplicates Z: 16 8.266 1.789 0.499 0.478 0.867 0.533 CB 0.938 16 residues pruned to eliminate duplicates Z: 42 24.599 2.012 0.680 0.563 0.878 0.634 CB 1.218 42 residues pruned to eliminate duplicates Z: 36 33.533 2.180 0.659 0.532 0.943 0.571 CA 1.611 36 residues pruned to eliminate duplicates Z: 14 15.140 1.903 0.316 0.857 0.923 0.692 CB 1.339 14 residues pruned to eliminate duplicates Z: 88 73.036 2.336 0.884 0.617 0.943 0.655 CB 1.689 88 residues pruned to eliminate duplicates Z: 11 23.759 2.349 0.626 0.692 1.000 0.900 CA 1.651 11 residues pruned to eliminate duplicates Z: 8 3.201 1.617 -0.118 0.247 0.857 0.429 CB 1.325 Z: 8 8.304 1.892 -0.256 0.860 1.000 1.000 CB 1.640 Z: 49 57.298 2.345 1.005 0.583 0.917 0.708 CB 1.772 19 residues pruned to eliminate duplicates Z: 12 14.618 1.689 0.688 0.928 1.000 0.818 CB 1.083 11 residues pruned to eliminate duplicates Z: 12 25.938 2.243 0.994 0.739 0.909 0.818 CB 1.553 12 residues pruned to eliminate duplicates Z: 6 5.846 1.796 0.483 0.760 0.800 0.400 CA 0.974 Z: 10 12.651 1.810 0.492 0.900 1.000 0.778 CB 1.116 9 residues pruned to eliminate duplicates Z: 7 6.919 1.716 0.507 0.542 0.833 0.667 CA 1.258 7 residues pruned to eliminate duplicates Z: 6 2.534 1.916 -0.472 0.551 0.800 0.400 CB 1.332 3 residues pruned to eliminate duplicates Z: 13 20.081 1.971 0.649 0.910 0.917 0.583 CA 1.379 13 residues pruned to eliminate duplicates Z: 45 52.246 2.371 0.833 0.567 0.955 0.591 CA 1.780 45 residues pruned to eliminate duplicates Z: 13 9.254 1.833 0.623 0.332 0.750 0.667 CA 1.440 6 residues pruned to eliminate duplicates Z: 16 31.769 2.082 0.903 0.905 1.000 0.800 CB 1.474 16 residues pruned to eliminate duplicates Z: 100 77.837 2.362 1.007 0.584 0.909 0.586 CB 1.674 100 residues pruned to eliminate duplicates Z: 10 21.537 2.031 0.816 0.845 0.889 0.778 CA 1.627 10 residues pruned to eliminate duplicates Z: 69 55.708 2.214 0.757 0.652 0.912 0.662 CA 1.654 69 residues pruned to eliminate duplicates Z: 59 65.971 2.289 1.038 0.681 0.914 0.707 CB 1.721 59 residues pruned to eliminate duplicates Z: 12 15.116 1.840 0.627 0.830 1.000 0.636 CB 1.145 12 residues pruned to eliminate duplicates Z: 88 72.939 2.330 0.939 0.616 0.943 0.598 CB 1.646 88 residues pruned to eliminate duplicates Z: 16 22.530 1.926 0.968 0.853 0.933 0.533 CA 1.215 16 residues pruned to eliminate duplicates Z: 10 19.251 2.046 0.665 0.867 1.000 0.444 CB 1.378 10 residues pruned to eliminate duplicates Z: 11 19.731 1.977 0.708 0.870 1.000 0.700 CB 1.349 11 residues pruned to eliminate duplicates Z: 64 57.246 2.411 0.889 0.555 0.889 0.651 CB 1.689 64 residues pruned to eliminate duplicates Z: 11 4.896 1.633 0.293 0.258 0.700 0.300 CB 1.382 3 residues pruned to eliminate duplicates Z: 6 3.140 1.489 0.973 0.100 0.800 0.400 CA 0.996 Z: 10 15.854 2.026 0.507 0.853 0.889 0.444 CB 1.439 10 residues pruned to eliminate duplicates Z: 11 14.056 1.783 0.619 0.893 1.000 0.900 CB 1.105 11 residues pruned to eliminate duplicates Z: 6 6.701 2.087 -0.259 0.819 1.000 0.800 CB 1.470 9 residues pruned to eliminate duplicates Z: 10 3.852 1.649 -0.208 0.576 0.667 0.444 O 1.370 9 residues pruned to eliminate duplicates Z: 15 37.914 2.182 1.131 0.941 1.000 0.714 CB 1.512 15 residues pruned to eliminate duplicates Z: 13 23.783 2.126 0.538 0.866 1.000 0.833 CB 1.537 13 residues pruned to eliminate duplicates Z: 16 24.361 2.057 0.391 0.916 1.000 0.800 CA 1.553 16 residues pruned to eliminate duplicates Z: 13 21.517 2.171 0.716 0.674 0.917 0.583 CB 1.549 13 residues pruned to eliminate duplicates Z: 32 53.173 2.346 1.200 0.635 0.903 0.677 CB 1.805 32 residues pruned to eliminate duplicates Z: 7 10.247 1.813 0.734 0.603 1.000 0.500 CB 1.207 Z: 9 21.714 2.105 0.507 0.900 1.000 0.875 CB 1.728 10 residues pruned to eliminate duplicates Z: 20 40.038 2.467 0.930 0.695 0.895 0.737 CA 1.804 20 residues pruned to eliminate duplicates Z: 13 15.748 1.963 0.472 0.811 0.917 0.583 CA 1.310 13 residues pruned to eliminate duplicates Z: 15 20.036 2.163 0.901 0.838 0.714 0.286 CB 1.362 15 residues pruned to eliminate duplicates Z: 14 21.164 1.882 0.534 0.897 1.000 0.846 CB 1.455 14 residues pruned to eliminate duplicates Z: 12 14.901 1.892 0.598 0.805 0.909 0.636 CB 1.252 12 residues pruned to eliminate duplicates Z: 13 13.913 1.960 0.070 0.918 1.000 1.000 CA 1.350 13 residues pruned to eliminate duplicates Z: 13 19.000 1.936 0.433 0.829 1.000 0.917 CA 1.488 13 residues pruned to eliminate duplicates Z: 10 10.415 1.967 -0.146 0.935 1.000 1.000 CB 1.440 10 residues pruned to eliminate duplicates Z: 9 13.281 1.894 0.733 0.620 0.875 0.750 CB 1.460 8 residues pruned to eliminate duplicates Z: 16 9.727 1.781 0.729 0.339 0.800 0.400 CA 1.215 16 residues pruned to eliminate duplicates Z: 147 83.818 2.214 0.861 0.609 0.952 0.582 CB 1.595 147 residues pruned to eliminate duplicates Z: 22 12.715 2.008 0.510 0.490 0.762 0.619 CB 1.213 22 residues pruned to eliminate duplicates Z: 7 13.132 2.092 0.740 0.673 0.833 0.667 CB 1.507 7 residues pruned to eliminate duplicates Z: 58 58.234 2.346 0.966 0.565 0.912 0.632 CB 1.721 58 residues pruned to eliminate duplicates Z: 151 93.030 2.316 0.909 0.614 0.933 0.620 CB 1.653 151 residues pruned to eliminate duplicates Z: 10 9.709 2.089 0.504 0.300 0.778 0.778 CB 1.656 10 residues pruned to eliminate duplicates Z: 8 10.780 1.796 0.218 0.837 1.000 0.857 CA 1.392 8 residues pruned to eliminate duplicates Z: 21 29.263 2.136 0.874 0.602 1.000 0.600 CB 1.483 21 residues pruned to eliminate duplicates Z: 15 33.697 2.067 1.124 0.905 0.929 0.857 CB 1.572 15 residues pruned to eliminate duplicates Z: 15 31.780 2.206 0.783 0.906 1.000 0.929 CA 1.536 15 residues pruned to eliminate duplicates Z: 14 36.554 2.404 1.041 0.885 0.923 0.538 CB 1.617 14 residues pruned to eliminate duplicates Z: 16 18.882 1.759 0.679 0.851 0.933 0.733 CB 1.309 16 residues pruned to eliminate duplicates Z: 15 46.179 2.419 1.251 0.913 1.000 0.714 CB 1.604 15 residues pruned to eliminate duplicates Z: 24 8.735 1.619 0.191 0.465 0.870 0.478 CB 1.125 11 residues pruned to eliminate duplicates Z: 8 6.615 1.456 0.669 0.475 0.857 0.714 N 1.231 Z: 16 24.939 2.063 0.434 0.912 1.000 0.733 CB 1.542 16 residues pruned to eliminate duplicates Z: 8 25.372 2.417 0.803 0.881 1.000 0.857 CB 1.594 8 residues pruned to eliminate duplicates Z: 59 71.623 2.387 1.084 0.635 0.914 0.655 CB 1.823 57 residues pruned to eliminate duplicates Z: 60 68.164 2.405 1.092 0.595 0.915 0.559 CB 1.759 44 residues pruned to eliminate duplicates Z: 15 15.270 1.941 0.472 0.633 0.929 0.714 CB 1.358 15 residues pruned to eliminate duplicates Z: 11 14.940 1.885 0.609 0.892 1.000 0.700 CB 1.119 11 residues pruned to eliminate duplicates Z: 16 25.793 2.016 0.558 0.890 1.000 0.667 CA 1.525 16 residues pruned to eliminate duplicates Z: 10 18.888 2.085 0.560 0.828 1.000 1.000 CA 1.457 10 residues pruned to eliminate duplicates Z: 16 38.662 2.219 0.939 0.879 1.000 0.733 CB 1.683 16 residues pruned to eliminate duplicates Z: 7 3.251 1.664 0.541 0.259 0.833 0.333 CB 0.818 7 residues pruned to eliminate duplicates Z: 16 25.900 2.025 0.564 0.922 1.000 0.933 CA 1.485 16 residues pruned to eliminate duplicates Z: 24 21.942 1.897 0.824 0.709 0.870 0.696 CA 1.259 24 residues pruned to eliminate duplicates Z: 16 25.852 2.204 0.634 0.898 0.933 0.800 CA 1.421 16 residues pruned to eliminate duplicates Z: 14 19.648 1.919 0.733 0.862 0.846 0.615 CB 1.423 14 residues pruned to eliminate duplicates Z: 12 16.550 1.840 0.953 0.731 0.818 0.545 CB 1.379 12 residues pruned to eliminate duplicates Z: 10 12.559 1.728 1.028 0.768 0.889 0.889 CA 1.060 10 residues pruned to eliminate duplicates Z: 14 20.465 2.020 0.452 0.867 1.000 0.769 CB 1.415 14 residues pruned to eliminate duplicates Z: 61 67.249 2.432 1.028 0.575 0.917 0.583 CB 1.787 61 residues pruned to eliminate duplicates Z: 11 11.606 1.905 0.574 0.743 0.800 0.500 CA 1.230 11 residues pruned to eliminate duplicates Z: 44 45.483 2.274 0.828 0.666 0.930 0.605 CB 1.539 44 residues pruned to eliminate duplicates Z: 59 59.573 2.187 0.980 0.644 0.948 0.672 CB 1.665 59 residues pruned to eliminate duplicates Z: 8 9.295 1.751 0.137 0.830 1.000 0.571 CA 1.327 8 residues pruned to eliminate duplicates Z: 122 88.886 2.441 0.893 0.610 0.909 0.579 CB 1.733 122 residues pruned to eliminate duplicates Z: 11 3.809 1.489 0.235 0.387 0.800 0.400 CB 0.924 Z: 90 74.752 2.419 0.943 0.596 0.899 0.562 CB 1.711 90 residues pruned to eliminate duplicates Z: 9 7.558 1.492 0.802 0.743 0.875 0.500 CB 0.914 9 residues pruned to eliminate duplicates Z: 25 24.033 2.074 0.589 0.560 1.000 0.583 CA 1.405 25 residues pruned to eliminate duplicates Z: 42 48.656 2.227 0.934 0.673 0.976 0.707 CB 1.542 42 residues pruned to eliminate duplicates Z: 6 3.194 1.656 0.182 0.297 0.800 0.400 CB 1.145 Z: 8 5.427 1.888 -0.292 0.758 1.000 1.000 CB 1.219 Z: 25 16.524 1.964 0.835 0.329 0.875 0.583 CB 1.290 25 residues pruned to eliminate duplicates Z: 16 29.075 2.148 0.786 0.888 0.933 0.667 CA 1.510 16 residues pruned to eliminate duplicates Z: 150 79.712 2.206 0.808 0.609 0.913 0.671 CB 1.618 150 residues pruned to eliminate duplicates Z: 8 4.850 1.758 0.643 0.412 0.714 0.714 CA 0.974 8 residues pruned to eliminate duplicates Z: 59 43.713 2.167 0.795 0.555 0.897 0.621 CB 1.560 59 residues pruned to eliminate duplicates Z: 40 26.188 2.203 0.805 0.370 0.744 0.308 CB 1.631 31 residues pruned to eliminate duplicates Z: 8 11.275 1.895 0.751 0.610 1.000 0.571 CB 1.156 8 residues pruned to eliminate duplicates Z: 9 11.946 1.987 0.020 0.918 1.000 1.000 CB 1.468 9 residues pruned to eliminate duplicates Z: 90 66.382 2.255 0.825 0.621 0.899 0.607 CB 1.697 90 residues pruned to eliminate duplicates Z: 8 8.519 1.843 0.052 0.783 1.000 0.429 CB 1.295 8 residues pruned to eliminate duplicates Z: 10 21.208 2.072 0.945 0.830 1.000 0.778 CA 1.319 10 residues pruned to eliminate duplicates Z: 84 63.010 2.380 0.938 0.553 0.904 0.554 CB 1.575 90 residues pruned to eliminate duplicates Z: 15 23.171 2.032 1.156 0.938 1.000 0.571 CB 0.983 15 residues pruned to eliminate duplicates Z: 6 7.333 1.711 -0.021 0.813 1.000 1.000 O 1.491 Z: 33 25.005 2.121 0.600 0.556 0.906 0.562 CB 1.361 33 residues pruned to eliminate duplicates Z: 8 2.802 1.501 0.196 0.411 0.714 0.571 C 0.907 Z: 6 8.808 1.947 0.317 0.857 0.800 0.600 CA 1.415 6 residues pruned to eliminate duplicates Z: 8 7.384 1.734 -0.045 0.787 1.000 0.857 CA 1.309 8 residues pruned to eliminate duplicates Z: 12 8.718 1.561 0.405 0.783 0.909 0.545 CB 1.028 12 residues pruned to eliminate duplicates Z: 41 36.910 2.299 0.796 0.504 0.875 0.650 CA 1.608 41 residues pruned to eliminate duplicates Z: 10 14.494 1.831 0.793 0.889 1.000 0.778 CB 1.059 10 residues pruned to eliminate duplicates Z: 68 40.783 2.143 0.713 0.508 0.881 0.567 CB 1.529 68 residues pruned to eliminate duplicates Z: 7 5.465 1.569 0.358 0.630 0.833 0.500 CA 1.112 7 residues pruned to eliminate duplicates Z: 9 10.382 1.785 1.210 0.579 0.875 0.750 CB 0.986 Z: 37 59.126 2.331 1.192 0.688 0.944 0.667 CA 1.718 39 residues pruned to eliminate duplicates Z: 28 38.980 2.289 0.895 0.560 0.926 0.667 CB 1.763 28 residues pruned to eliminate duplicates Z: 20 21.188 2.062 0.777 0.484 0.895 0.526 CB 1.506 20 residues pruned to eliminate duplicates Z: 26 21.266 1.826 0.893 0.684 0.880 0.720 CA 1.181 26 residues pruned to eliminate duplicates Z: 69 73.247 2.422 1.039 0.606 0.897 0.618 CB 1.814 69 residues pruned to eliminate duplicates Z: 9 9.702 1.551 0.793 0.793 0.875 0.625 CA 1.090 9 residues pruned to eliminate duplicates Z: 19 27.216 2.146 0.796 0.560 0.944 0.556 CA 1.663 19 residues pruned to eliminate duplicates Z: 10 7.546 1.571 1.161 0.490 0.667 0.556 CB 1.123 Z: 16 28.757 2.152 0.750 0.919 0.933 0.800 CA 1.489 16 residues pruned to eliminate duplicates Z: 55 65.905 2.473 1.077 0.621 0.889 0.648 CB 1.751 55 residues pruned to eliminate duplicates Z: 71 65.258 2.292 0.881 0.661 0.914 0.643 CB 1.705 71 residues pruned to eliminate duplicates Z: 69 60.165 2.178 0.944 0.637 0.941 0.559 CB 1.610 69 residues pruned to eliminate duplicates Z: 65 61.949 2.215 0.832 0.678 0.953 0.641 CB 1.699 65 residues pruned to eliminate duplicates Z: 29 59.424 2.488 1.232 0.648 0.964 0.714 CA 1.827 29 residues pruned to eliminate duplicates Z: 31 42.986 2.332 1.026 0.579 0.867 0.700 CB 1.776 31 residues pruned to eliminate duplicates Z: 16 22.893 2.144 0.860 0.800 0.800 0.333 CB 1.425 16 residues pruned to eliminate duplicates Z: 17 40.708 2.292 1.134 0.902 0.875 0.688 CA 1.697 17 residues pruned to eliminate duplicates Z: 121 78.198 2.247 0.869 0.605 0.917 0.592 CB 1.678 121 residues pruned to eliminate duplicates Z: 15 15.782 1.906 0.737 0.903 1.000 0.643 CB 0.908 15 residues pruned to eliminate duplicates Z: 21 19.122 2.130 0.672 0.508 0.900 0.500 CB 1.323 21 residues pruned to eliminate duplicates Z: 8 2.551 1.560 0.526 0.192 0.571 0.429 N 1.024 Z: 82 65.885 2.298 0.858 0.631 0.914 0.630 CB 1.660 82 residues pruned to eliminate duplicates Z: 9 10.324 2.041 0.079 0.808 0.875 0.375 CA 1.447 9 residues pruned to eliminate duplicates Z: 7 7.969 1.854 0.279 0.640 0.833 0.667 CB 1.444 7 residues pruned to eliminate duplicates Z: 68 28.537 1.966 0.802 0.467 0.851 0.537 CB 1.197 68 residues pruned to eliminate duplicates Z: 9 14.957 1.874 0.592 0.921 1.000 0.875 CB 1.247 9 residues pruned to eliminate duplicates Z: 10 14.967 1.871 0.491 0.855 1.000 1.000 CB 1.319 10 residues pruned to eliminate duplicates Z: 9 28.622 2.302 0.911 0.914 1.000 0.750 CB 1.626 9 residues pruned to eliminate duplicates Z: 15 27.857 2.247 0.585 0.885 1.000 0.857 CA 1.509 15 residues pruned to eliminate duplicates Z: 58 50.051 2.339 0.939 0.529 0.877 0.596 CB 1.620 58 residues pruned to eliminate duplicates Z: 9 11.437 1.648 0.929 0.798 0.875 0.625 CB 1.120 9 residues pruned to eliminate duplicates Z: 7 8.636 1.725 0.871 0.615 0.833 0.500 CA 1.176 7 residues pruned to eliminate duplicates Z: 6 14.366 2.297 0.491 0.613 1.000 0.600 CB 1.685 6 residues pruned to eliminate duplicates Z: 11 14.619 1.734 0.917 0.875 0.900 0.700 CB 1.123 11 residues pruned to eliminate duplicates Z: 14 16.395 2.001 0.535 0.901 1.000 0.846 CB 1.056 14 residues pruned to eliminate duplicates Z: 20 20.373 2.124 0.381 0.539 0.947 0.526 CA 1.618 20 residues pruned to eliminate duplicates Z: 8 7.698 1.654 0.608 0.487 0.857 0.429 CB 1.293 8 residues pruned to eliminate duplicates Z: 9 12.722 1.894 0.642 0.844 0.875 0.625 CB 1.230 9 residues pruned to eliminate duplicates Z: 32 54.606 2.393 1.227 0.629 0.903 0.581 CB 1.804 32 residues pruned to eliminate duplicates Z: 14 10.600 1.919 0.504 0.369 0.846 0.538 CB 1.385 14 residues pruned to eliminate duplicates Z: 11 6.352 1.526 0.501 0.599 0.800 0.500 CB 0.998 11 residues pruned to eliminate duplicates Z: 7 2.818 1.609 -0.283 0.527 0.833 0.833 CB 1.165 7 residues pruned to eliminate duplicates Z: 85 68.791 2.238 0.832 0.652 0.952 0.679 CB 1.669 85 residues pruned to eliminate duplicates Z: 8 8.548 1.760 0.294 0.513 1.000 0.714 CB 1.399 8 residues pruned to eliminate duplicates Z: 6 2.694 1.714 -0.340 0.624 0.800 0.800 N 1.185 Z: 16 15.612 1.923 0.594 0.564 0.867 0.533 CB 1.426 16 residues pruned to eliminate duplicates Z: 62 35.769 2.110 0.630 0.504 0.885 0.639 CB 1.498 62 residues pruned to eliminate duplicates Z: 122 77.865 2.314 0.900 0.546 0.926 0.620 CB 1.663 122 residues pruned to eliminate duplicates Z: 91 50.373 2.136 0.737 0.538 0.911 0.633 CB 1.512 91 residues pruned to eliminate duplicates Z: 33 25.282 2.163 0.664 0.448 0.906 0.594 CB 1.446 33 residues pruned to eliminate duplicates Z: 8 8.262 1.736 0.033 0.757 1.000 0.714 CA 1.385 8 residues pruned to eliminate duplicates Z: 7 2.605 1.548 0.389 0.411 0.667 0.500 CB 0.814 Z: 6 2.859 1.395 0.118 0.441 1.000 0.600 CB 0.871 Z: 93 62.234 2.187 0.799 0.617 0.924 0.630 CB 1.597 93 residues pruned to eliminate duplicates Z: 25 17.621 1.871 0.416 0.600 0.875 0.667 CB 1.410 25 residues pruned to eliminate duplicates Z: 15 18.599 1.831 0.573 0.867 0.929 0.786 CA 1.359 15 residues pruned to eliminate duplicates Z: 71 73.330 2.309 1.050 0.685 0.943 0.700 CB 1.657 71 residues pruned to eliminate duplicates Z: 7 3.511 1.902 -0.236 0.440 0.833 0.333 CB 1.259 7 residues pruned to eliminate duplicates Z: 112 82.797 2.371 0.927 0.635 0.946 0.586 CB 1.601 112 residues pruned to eliminate duplicates Z: 25 35.772 2.279 0.938 0.582 0.917 0.708 CB 1.667 25 residues pruned to eliminate duplicates Z: 11 43.286 2.472 1.289 0.922 0.900 0.700 CB 1.890 11 residues pruned to eliminate duplicates Z: 15 33.563 2.160 1.015 0.910 1.000 0.429 CA 1.461 15 residues pruned to eliminate duplicates Z: 110 85.386 2.305 0.977 0.658 0.963 0.670 CB 1.609 110 residues pruned to eliminate duplicates Z: 9 4.190 1.386 0.769 0.444 0.750 0.625 CB 0.854 9 residues pruned to eliminate duplicates Z: 29 31.022 2.225 0.779 0.528 0.929 0.750 CB 1.552 29 residues pruned to eliminate duplicates Z: 154 85.507 2.281 0.840 0.557 0.948 0.634 CB 1.644 154 residues pruned to eliminate duplicates Z: 13 32.435 2.326 0.836 0.836 0.833 0.333 CB 1.969 13 residues pruned to eliminate duplicates Z: 41 24.651 1.970 0.789 0.506 0.850 0.650 CB 1.294 41 residues pruned to eliminate duplicates Z: 34 38.653 2.312 0.915 0.548 0.939 0.636 CB 1.545 34 residues pruned to eliminate duplicates Z: 6 2.283 1.098 0.520 0.752 1.000 0.800 CB 0.488 6 residues pruned to eliminate duplicates Z: 87 75.964 2.395 0.994 0.589 0.895 0.674 CB 1.759 87 residues pruned to eliminate duplicates Z: 6 2.059 1.681 0.267 0.683 0.800 0.800 CB 0.457 Z: 6 14.223 1.723 1.073 0.815 1.000 0.800 CA 1.354 Z: 17 9.194 1.696 0.507 0.349 0.938 0.562 CB 1.130 13 residues pruned to eliminate duplicates Z: 29 42.577 2.305 0.860 0.618 0.964 0.786 CA 1.741 29 residues pruned to eliminate duplicates Z: 8 9.681 1.655 0.743 0.738 1.000 0.714 CB 1.025 8 residues pruned to eliminate duplicates Z: 74 41.728 2.171 0.748 0.477 0.877 0.603 CB 1.503 74 residues pruned to eliminate duplicates Z: 10 7.021 1.714 0.743 0.357 1.000 0.333 CB 0.914 10 residues pruned to eliminate duplicates Z: 16 11.044 1.862 0.522 0.392 0.867 0.400 CB 1.302 16 residues pruned to eliminate duplicates Z: 10 12.889 1.626 1.006 0.772 0.889 0.556 CA 1.165 10 residues pruned to eliminate duplicates Z: 31 32.795 2.274 0.988 0.482 0.800 0.467 CA 1.685 31 residues pruned to eliminate duplicates Z: 7 6.286 1.482 0.608 0.535 0.833 0.333 CA 1.249 7 residues pruned to eliminate duplicates Z: 73 52.754 2.227 0.955 0.550 0.875 0.694 CB 1.555 73 residues pruned to eliminate duplicates Z: 74 67.099 2.325 1.084 0.550 0.918 0.575 CB 1.682 73 residues pruned to eliminate duplicates Z: 8 8.161 1.648 0.525 0.773 0.857 0.714 CB 1.125 8 residues pruned to eliminate duplicates Z: 11 14.483 2.024 0.571 0.834 0.900 0.700 CB 1.199 11 residues pruned to eliminate duplicates Z: 16 32.502 2.175 0.968 0.919 0.933 0.733 CA 1.480 16 residues pruned to eliminate duplicates Z: 67 64.502 2.328 0.988 0.566 0.939 0.667 CB 1.712 67 residues pruned to eliminate duplicates Z: 17 30.825 2.143 0.578 0.817 1.000 0.562 CA 1.729 17 residues pruned to eliminate duplicates Z: 12 19.486 1.863 0.749 0.835 1.000 0.545 CB 1.351 12 residues pruned to eliminate duplicates Z: 93 93.300 2.406 1.137 0.641 0.935 0.598 CB 1.774 93 residues pruned to eliminate duplicates Z: 8 4.821 1.837 -0.008 0.316 0.857 0.714 CB 1.430 4 residues pruned to eliminate duplicates Z: 13 18.821 1.934 0.741 0.810 0.833 0.667 CA 1.478 13 residues pruned to eliminate duplicates Z: 35 25.702 2.102 0.741 0.385 0.912 0.559 CB 1.492 35 residues pruned to eliminate duplicates Z: 8 3.554 1.402 0.604 0.395 0.714 0.571 CB 0.934 Z: 15 32.147 2.230 0.794 0.913 1.000 0.714 CA 1.519 15 residues pruned to eliminate duplicates Z: 15 16.065 1.950 0.606 0.615 0.857 0.714 CB 1.434 15 residues pruned to eliminate duplicates Z: 7 4.785 1.614 -0.027 0.693 0.833 0.833 CA 1.251 Z: 22 28.114 2.123 0.958 0.572 1.000 0.571 CB 1.376 22 residues pruned to eliminate duplicates Z: 75 54.179 2.118 0.883 0.623 0.905 0.568 CB 1.553 75 residues pruned to eliminate duplicates Z: 8 4.617 1.620 -0.107 0.577 1.000 0.714 C 1.120 Z: 41 19.880 1.929 0.360 0.411 0.875 0.625 CB 1.503 47 residues pruned to eliminate duplicates Z: 7 3.880 1.700 0.573 0.319 0.667 0.500 CB 1.085 6 1.953 1.468 0.704 0.310 0.400 0.400 C 1.077 ? Z: 7 5.011 1.635 -0.163 0.744 1.000 0.667 N 1.202 Z: 13 8.190 1.557 0.256 0.758 0.833 0.583 CA 1.153 13 residues pruned to eliminate duplicates Z: 138 85.688 2.242 0.859 0.627 0.949 0.635 CB 1.642 138 residues pruned to eliminate duplicates Z: 16 46.398 2.381 1.359 0.902 0.933 0.667 CB 1.630 16 residues pruned to eliminate duplicates Z: 12 21.872 1.903 1.118 0.809 0.909 0.455 CB 1.375 12 residues pruned to eliminate duplicates Z: 15 4.842 1.637 0.168 0.258 0.786 0.429 CB 1.136 Z: 11 18.021 1.990 0.793 0.805 0.900 0.900 CA 1.359 11 residues pruned to eliminate duplicates Z: 6 3.493 1.820 -0.274 0.694 1.000 0.600 CB 0.991 6 residues pruned to eliminate duplicates Z: 6 2.265 1.246 0.417 0.591 0.800 0.600 N 0.657 6 residues pruned to eliminate duplicates Z: 63 61.071 2.269 0.975 0.609 0.935 0.645 CB 1.667 63 residues pruned to eliminate duplicates Z: 7 5.327 1.454 0.719 0.860 1.000 0.500 CB 0.640 Z: 15 25.469 2.051 0.551 0.909 1.000 0.786 CB 1.519 15 residues pruned to eliminate duplicates Z: 10 19.526 2.148 0.816 0.798 0.889 0.667 CA 1.447 10 residues pruned to eliminate duplicates Z: 11 5.761 1.543 0.614 0.531 0.800 0.700 CB 0.886 11 residues pruned to eliminate duplicates Z: 9 11.426 1.831 0.682 0.590 0.875 0.500 CB 1.375 9 residues pruned to eliminate duplicates Z: 71 76.815 2.336 1.244 0.638 0.900 0.629 CB 1.710 71 residues pruned to eliminate duplicates Z: 7 3.022 1.613 0.111 0.386 0.667 0.333 C 1.165 Z: 18 25.112 1.984 0.619 0.757 0.941 0.529 CA 1.604 18 residues pruned to eliminate duplicates Z: 52 58.275 2.315 1.079 0.656 0.922 0.745 CB 1.592 52 residues pruned to eliminate duplicates 6 1.624 1.376 -0.071 0.382 0.600 0.400 C 1.074 ? Z: 15 6.582 1.617 0.164 0.546 0.786 0.357 CB 1.138 Z: 13 28.162 2.367 0.655 0.901 0.917 0.667 CB 1.616 13 residues pruned to eliminate duplicates Z: 11 4.891 1.738 0.147 0.476 0.600 0.500 CB 1.325 11 residues pruned to eliminate duplicates Z: 12 13.166 1.750 0.487 0.882 1.000 0.818 CB 1.104 12 residues pruned to eliminate duplicates Z: 10 11.201 1.553 0.804 0.802 0.889 0.556 CB 1.152 10 residues pruned to eliminate duplicates Z: 9 8.115 1.671 0.071 0.756 1.000 0.625 CB 1.276 9 residues pruned to eliminate duplicates Z: 10 14.877 2.091 0.478 0.759 0.889 0.778 CA 1.434 10 residues pruned to eliminate duplicates Z: 56 50.203 2.263 0.902 0.609 0.909 0.509 CB 1.560 56 residues pruned to eliminate duplicates Z: 65 45.604 2.151 0.708 0.544 0.922 0.594 CB 1.612 65 residues pruned to eliminate duplicates Z: 9 6.162 1.545 0.537 0.513 0.750 0.625 N 1.208 9 residues pruned to eliminate duplicates Z: 27 21.201 2.120 0.549 0.435 0.885 0.615 CB 1.530 27 residues pruned to eliminate duplicates Z: 6 4.606 1.356 0.414 0.736 1.000 0.800 C 0.869 6 residues pruned to eliminate duplicates Z: 37 37.371 2.113 0.896 0.530 0.972 0.667 CB 1.553 37 residues pruned to eliminate duplicates Z: 11 17.413 1.769 1.096 0.772 0.900 0.500 CA 1.297 11 residues pruned to eliminate duplicates Z: 10 13.751 1.975 0.430 0.812 0.889 0.444 CA 1.392 10 residues pruned to eliminate duplicates Z: 11 11.284 1.680 0.740 0.855 0.900 0.700 CB 1.001 11 residues pruned to eliminate duplicates Z: 14 20.786 2.042 0.858 0.942 1.000 0.923 CB 1.054 14 residues pruned to eliminate duplicates Z: 11 6.105 1.553 0.060 0.707 0.900 0.500 CB 1.080 8 residues pruned to eliminate duplicates Z: 9 8.337 1.846 0.597 0.378 1.000 0.625 CB 1.139 9 residues pruned to eliminate duplicates Z: 12 7.616 1.610 0.107 0.591 0.909 0.545 CB 1.299 8 residues pruned to eliminate duplicates Z: 8 10.278 1.665 0.224 0.864 1.000 0.571 CB 1.397 8 residues pruned to eliminate duplicates Z: 30 23.675 1.909 0.735 0.611 0.931 0.759 CB 1.283 30 residues pruned to eliminate duplicates Z: 7 2.965 1.702 0.204 0.648 0.833 0.500 CB 0.617 Z: 7 14.975 1.776 1.184 0.874 1.000 0.667 CB 1.148 7 residues pruned to eliminate duplicates Z: 8 3.815 1.588 0.036 0.353 0.857 0.429 CA 1.199 8 residues pruned to eliminate duplicates Z: 7 3.441 1.705 -0.226 0.665 0.833 0.667 O 1.096 7 residues pruned to eliminate duplicates Z: 11 13.627 2.153 0.855 0.321 0.900 0.500 CA 1.461 11 residues pruned to eliminate duplicates Z: 16 33.719 2.138 1.046 0.928 1.000 0.867 CB 1.394 16 residues pruned to eliminate duplicates Z: 26 42.985 2.379 1.232 0.591 0.920 0.680 CB 1.613 26 residues pruned to eliminate duplicates Z: 65 49.178 2.260 0.705 0.627 0.906 0.656 CB 1.563 65 residues pruned to eliminate duplicates Z: 11 13.553 1.769 0.673 0.900 1.000 0.800 CB 1.035 11 residues pruned to eliminate duplicates Z: 16 22.000 2.005 0.512 0.832 1.000 0.733 CA 1.406 16 residues pruned to eliminate duplicates Z: 13 14.845 1.863 0.715 0.647 0.833 0.500 CA 1.403 13 residues pruned to eliminate duplicates Z: 18 13.447 1.956 0.519 0.486 0.941 0.353 CB 1.183 18 residues pruned to eliminate duplicates Z: 24 44.369 2.361 1.061 0.625 0.957 0.478 CA 1.767 24 residues pruned to eliminate duplicates Z: 16 19.255 2.061 0.730 0.832 0.867 0.533 CB 1.208 16 residues pruned to eliminate duplicates Z: 6 3.579 1.430 0.071 0.815 1.000 0.800 CB 0.794 Z: 6 8.545 1.815 0.230 0.834 1.000 0.400 CB 1.283 6 residues pruned to eliminate duplicates Z: 19 12.605 1.694 0.602 0.530 0.889 0.556 CB 1.196 19 residues pruned to eliminate duplicates Z: 81 56.440 2.227 0.884 0.594 0.875 0.650 CB 1.572 81 residues pruned to eliminate duplicates Z: 89 65.615 2.209 0.847 0.630 0.943 0.614 CB 1.608 89 residues pruned to eliminate duplicates Z: 9 8.911 2.062 0.510 0.531 0.875 0.500 CB 1.121 9 residues pruned to eliminate duplicates Z: 7 7.331 1.510 0.754 0.639 1.000 0.833 CB 0.992 Z: 51 42.635 2.129 0.897 0.642 0.900 0.480 CB 1.453 51 residues pruned to eliminate duplicates Z: 37 20.886 1.924 0.678 0.528 0.833 0.583 CB 1.259 37 residues pruned to eliminate duplicates Z: 14 21.833 2.015 1.118 0.937 1.000 1.000 CB 0.988 14 residues pruned to eliminate duplicates Z: 21 15.996 1.993 0.651 0.340 0.900 0.600 CB 1.438 27 residues pruned to eliminate duplicates Z: 16 13.635 1.881 0.687 0.496 0.867 0.600 CB 1.285 16 residues pruned to eliminate duplicates Z: 66 57.553 2.259 0.858 0.663 0.892 0.646 CB 1.639 66 residues pruned to eliminate duplicates Z: 11 11.000 1.824 0.524 0.880 1.000 0.700 CB 0.907 11 residues pruned to eliminate duplicates Z: 13 12.377 1.917 0.530 0.579 0.833 0.583 CB 1.355 13 residues pruned to eliminate duplicates Z: 14 30.967 2.418 1.232 0.597 0.923 0.846 CB 1.571 14 residues pruned to eliminate duplicates Z: 105 55.623 2.124 0.793 0.526 0.923 0.548 CB 1.512 105 residues pruned to eliminate duplicates Z: 7 2.231 1.676 -0.129 0.423 1.000 0.667 CB 0.676 Z: 36 37.035 2.239 0.716 0.541 0.943 0.571 CB 1.659 36 residues pruned to eliminate duplicates Z: 10 12.813 2.199 0.505 0.728 0.889 0.444 CB 1.183 10 residues pruned to eliminate duplicates Z: 21 8.704 1.890 0.229 0.259 0.800 0.400 CB 1.380 27 residues pruned to eliminate duplicates Z: 15 10.758 1.895 0.644 0.306 0.929 0.429 CB 1.233 15 residues pruned to eliminate duplicates Z: 10 7.396 1.526 0.341 0.739 0.778 0.556 CB 1.251 10 residues pruned to eliminate duplicates Z: 15 17.283 1.963 0.698 0.925 1.000 0.929 CB 0.972 15 residues pruned to eliminate duplicates Z: 22 16.468 1.850 0.551 0.433 0.952 0.571 CB 1.409 22 residues pruned to eliminate duplicates Z: 15 8.202 1.659 0.455 0.411 0.786 0.500 CB 1.269 19 residues pruned to eliminate duplicates Z: 9 14.580 1.681 1.013 0.852 1.000 0.625 CB 1.127 7 residues pruned to eliminate duplicates Z: 7 5.031 1.895 -0.257 0.690 1.000 0.667 CB 1.227 7 residues pruned to eliminate duplicates Z: 9 6.420 1.746 0.623 0.655 0.875 0.750 CB 0.793 8 residues pruned to eliminate duplicates Z: 16 29.373 2.185 0.776 0.914 0.933 0.800 CA 1.481 16 residues pruned to eliminate duplicates Z: 100 75.295 2.310 0.861 0.619 0.960 0.636 CB 1.639 100 residues pruned to eliminate duplicates Z: 40 43.942 2.191 1.061 0.590 0.923 0.692 CA 1.549 40 residues pruned to eliminate duplicates Z: 46 48.732 2.379 0.779 0.569 0.978 0.622 CB 1.642 46 residues pruned to eliminate duplicates Z: 10 20.073 2.048 1.003 0.672 0.889 0.667 CB 1.566 10 residues pruned to eliminate duplicates Z: 16 45.122 2.305 1.051 0.923 1.000 1.000 CA 1.731 16 residues pruned to eliminate duplicates Z: 8 9.036 1.644 0.989 0.557 0.857 0.714 CA 1.153 9 residues pruned to eliminate duplicates Z: 51 57.752 2.386 0.992 0.592 0.920 0.640 CB 1.711 51 residues pruned to eliminate duplicates Z: 104 74.942 2.325 0.882 0.623 0.922 0.621 CB 1.630 104 residues pruned to eliminate duplicates Z: 19 8.013 1.914 0.305 0.274 0.722 0.500 CB 1.352 19 residues pruned to eliminate duplicates Z: 24 19.105 2.066 0.731 0.511 0.783 0.565 CB 1.408 24 residues pruned to eliminate duplicates Z: 10 6.308 1.789 -0.174 0.705 1.000 0.667 CB 1.180 10 residues pruned to eliminate duplicates Z: 13 57.037 2.443 1.448 0.945 1.000 0.833 CA 1.905 13 residues pruned to eliminate duplicates Z: 12 17.032 2.189 0.423 0.549 1.000 0.545 CB 1.572 12 residues pruned to eliminate duplicates Z: 80 55.013 2.152 0.849 0.536 0.949 0.620 CB 1.582 80 residues pruned to eliminate duplicates Z: 6 5.929 1.447 0.621 0.802 1.000 1.000 N 0.868 Z: 103 81.268 2.257 0.980 0.676 0.951 0.637 CB 1.609 103 residues pruned to eliminate duplicates Z: 29 37.665 2.327 0.838 0.579 0.929 0.643 CB 1.661 29 residues pruned to eliminate duplicates Z: 88 71.173 2.390 0.976 0.570 0.908 0.632 CB 1.663 88 residues pruned to eliminate duplicates Z: 16 32.525 2.194 0.844 0.930 1.000 0.667 CA 1.451 16 residues pruned to eliminate duplicates Z: 97 71.508 2.345 0.860 0.611 0.906 0.635 CB 1.662 97 residues pruned to eliminate duplicates Z: 19 17.072 1.963 0.833 0.536 0.889 0.611 CB 1.215 19 residues pruned to eliminate duplicates Z: 15 19.991 2.023 0.752 0.925 1.000 0.929 CB 1.058 15 residues pruned to eliminate duplicates Z: 56 56.963 2.350 0.933 0.607 0.891 0.509 CB 1.714 56 residues pruned to eliminate duplicates Z: 13 17.436 1.854 0.640 0.839 0.917 0.250 CB 1.348 13 residues pruned to eliminate duplicates Z: 7 2.887 1.738 -0.242 0.434 1.000 0.500 CB 0.957 7 residues pruned to eliminate duplicates Z: 52 48.203 2.147 0.838 0.649 0.941 0.765 CB 1.582 52 residues pruned to eliminate duplicates Z: 9 12.985 1.837 0.532 0.908 1.000 1.000 CB 1.159 9 residues pruned to eliminate duplicates Z: 60 38.135 2.083 0.674 0.505 0.949 0.576 CB 1.493 60 residues pruned to eliminate duplicates 6 1.710 1.405 0.122 0.417 0.600 0.600 CB 0.881 ? Z: 7 3.948 1.414 0.411 0.409 0.833 0.500 C 1.067 Z: 6 6.534 2.265 0.481 0.308 0.800 0.400 CA 1.348 6 residues pruned to eliminate duplicates Z: 16 26.507 2.114 0.568 0.910 1.000 0.667 CB 1.464 16 residues pruned to eliminate duplicates Z: 83 65.917 2.304 0.882 0.626 0.890 0.598 CB 1.675 83 residues pruned to eliminate duplicates Z: 9 27.990 2.381 0.669 0.865 1.000 0.875 CA 1.825 9 residues pruned to eliminate duplicates Z: 19 12.082 1.900 0.547 0.441 0.889 0.500 CB 1.158 19 residues pruned to eliminate duplicates Z: 9 4.595 1.541 0.456 0.830 0.625 0.250 CB 0.871 9 residues pruned to eliminate duplicates Z: 6 3.593 1.658 -0.165 0.620 1.000 0.600 C 1.036 6 residues pruned to eliminate duplicates Z: 7 7.647 1.576 0.413 0.822 1.000 0.833 CB 1.060 7 residues pruned to eliminate duplicates Z: 16 14.657 1.984 0.773 0.250 0.933 0.533 CA 1.538 16 residues pruned to eliminate duplicates Z: 15 12.918 1.824 0.517 0.483 0.929 0.500 CA 1.367 15 residues pruned to eliminate duplicates Z: 66 63.359 2.277 1.060 0.603 0.892 0.600 CA 1.702 66 residues pruned to eliminate duplicates Z: 9 24.872 2.135 0.962 0.876 0.875 0.750 CA 1.743 9 residues pruned to eliminate duplicates Z: 10 10.791 1.856 0.265 0.538 1.000 0.556 N 1.476 5 residues pruned to eliminate duplicates Z: 16 31.709 2.168 0.967 0.875 0.933 0.533 CB 1.497 16 residues pruned to eliminate duplicates Z: 107 83.542 2.379 0.953 0.648 0.896 0.651 CB 1.697 107 residues pruned to eliminate duplicates Z: 19 8.722 1.667 0.232 0.515 0.778 0.444 CB 1.267 19 residues pruned to eliminate duplicates Z: 22 27.720 2.205 0.848 0.519 0.905 0.619 CB 1.610 22 residues pruned to eliminate duplicates Z: 9 14.743 1.964 0.676 0.915 1.000 0.625 CB 1.119 9 residues pruned to eliminate duplicates Z: 9 4.172 1.706 0.623 0.265 0.625 0.375 CA 1.114 9 residues pruned to eliminate duplicates Z: 7 10.567 1.681 1.283 0.797 1.000 0.833 N 0.867 Z: 19 16.751 2.038 0.647 0.383 0.889 0.556 CB 1.499 19 residues pruned to eliminate duplicates Z: 6 4.864 1.880 0.198 0.350 1.000 0.400 CA 1.136 6 residues pruned to eliminate duplicates Z: 87 73.105 2.321 0.920 0.620 0.930 0.709 CB 1.698 87 residues pruned to eliminate duplicates Z: 6 2.972 1.686 -0.164 0.294 1.000 0.600 CB 1.188 6 residues pruned to eliminate duplicates Z: 11 11.416 1.504 0.606 0.823 1.000 0.500 CB 1.130 11 residues pruned to eliminate duplicates 7 1.878 1.438 0.450 0.180 0.833 0.500 CB 0.649 ? Z: 17 18.173 2.102 0.842 0.439 0.875 0.438 CB 1.428 17 residues pruned to eliminate duplicates Z: 8 6.908 1.734 -0.126 0.666 1.000 0.714 CB 1.478 8 residues pruned to eliminate duplicates Z: 7 4.409 1.568 0.055 0.781 1.000 0.500 CB 0.849 Z: 14 16.689 2.109 0.334 0.883 1.000 0.846 CB 1.190 14 residues pruned to eliminate duplicates Z: 6 3.917 1.564 1.214 0.772 1.000 1.000 CB 0.398 Z: 25 15.956 1.919 0.651 0.312 0.917 0.583 CA 1.381 25 residues pruned to eliminate duplicates Z: 9 4.882 1.410 0.209 0.483 0.875 0.625 N 1.177 6 1.252 1.509 0.497 0.602 0.400 0.400 CB 0.562 ? Z: 10 5.199 1.403 0.524 0.336 0.889 0.556 CB 1.090 10 residues pruned to eliminate duplicates Z: 45 33.119 2.159 0.722 0.501 0.886 0.568 CB 1.514 45 residues pruned to eliminate duplicates Z: 25 28.174 2.353 0.771 0.459 0.875 0.625 CB 1.644 25 residues pruned to eliminate duplicates Z: 28 22.797 1.972 0.621 0.473 0.963 0.704 CA 1.464 28 residues pruned to eliminate duplicates Z: 14 16.401 2.002 0.514 0.499 1.000 0.615 CB 1.503 14 residues pruned to eliminate duplicates Z: 75 60.695 2.219 0.888 0.652 0.892 0.662 CB 1.639 75 residues pruned to eliminate duplicates Z: 10 4.802 1.690 0.717 0.293 0.778 0.444 CB 0.894 10 residues pruned to eliminate duplicates Z: 28 34.233 2.151 1.114 0.531 0.889 0.444 CB 1.580 28 residues pruned to eliminate duplicates Z: 9 9.067 1.714 0.406 0.430 1.000 0.750 CB 1.431 9 residues pruned to eliminate duplicates Z: 15 19.632 1.934 0.790 0.938 1.000 0.929 CB 1.054 15 residues pruned to eliminate duplicates Z: 86 71.086 2.337 0.996 0.602 0.918 0.635 CB 1.635 86 residues pruned to eliminate duplicates Z: 9 7.822 1.764 0.003 0.787 1.000 0.875 CB 1.215 9 residues pruned to eliminate duplicates Z: 9 12.778 1.826 1.237 0.470 0.750 0.500 CB 1.520 9 residues pruned to eliminate duplicates Z: 55 36.422 2.151 0.727 0.465 0.889 0.648 CB 1.555 55 residues pruned to eliminate duplicates Z: 53 51.945 2.376 0.869 0.562 0.923 0.596 CB 1.655 53 residues pruned to eliminate duplicates Z: 19 15.531 2.028 0.431 0.477 1.000 0.611 CB 1.291 19 residues pruned to eliminate duplicates Z: 116 76.176 2.185 0.896 0.644 0.939 0.635 CB 1.596 116 residues pruned to eliminate duplicates Z: 18 8.135 1.660 0.289 0.289 0.882 0.529 CB 1.323 18 residues pruned to eliminate duplicates Z: 30 43.823 2.296 1.095 0.588 0.931 0.586 CB 1.671 30 residues pruned to eliminate duplicates Z: 7 4.796 1.564 0.787 0.809 1.000 0.833 CB 0.535 Z: 21 40.517 2.478 1.020 0.725 0.900 0.650 CB 1.641 21 residues pruned to eliminate duplicates Z: 153 80.375 2.190 0.765 0.590 0.947 0.632 CB 1.633 153 residues pruned to eliminate duplicates Z: 54 63.928 2.387 0.991 0.632 0.925 0.642 CB 1.766 54 residues pruned to eliminate duplicates Z: 10 8.250 2.019 0.370 0.381 0.889 0.667 CB 1.270 10 residues pruned to eliminate duplicates Z: 20 16.211 1.804 0.721 0.404 1.000 0.737 CB 1.326 20 residues pruned to eliminate duplicates Z: 31 35.066 2.252 0.709 0.578 0.933 0.567 CA 1.654 31 residues pruned to eliminate duplicates Z: 51 33.466 2.061 0.722 0.545 0.880 0.560 CB 1.449 51 residues pruned to eliminate duplicates Z: 7 9.501 1.551 0.549 0.858 1.000 0.833 CB 1.189 Z: 10 20.601 2.240 0.480 0.875 1.000 0.667 CA 1.507 10 residues pruned to eliminate duplicates Z: 15 12.810 1.835 0.546 0.876 0.929 0.714 CB 0.945 15 residues pruned to eliminate duplicates Z: 27 20.173 1.981 0.434 0.501 0.923 0.615 CA 1.508 27 residues pruned to eliminate duplicates Z: 25 44.630 2.437 0.984 0.629 0.958 0.667 CB 1.742 25 residues pruned to eliminate duplicates Z: 16 13.762 1.878 0.556 0.856 0.933 0.867 CB 0.960 23 residues pruned to eliminate duplicates Z: 39 19.769 1.903 0.497 0.478 0.895 0.579 CB 1.286 39 residues pruned to eliminate duplicates Z: 13 13.091 2.030 0.580 0.429 0.917 0.583 CB 1.383 13 residues pruned to eliminate duplicates Z: 6 8.303 1.768 0.555 0.628 1.000 0.400 CB 1.198 6 residues pruned to eliminate duplicates Z: 7 3.416 1.523 0.548 0.398 0.667 0.333 CB 0.988 Z: 6 2.572 1.283 0.390 0.302 0.800 0.400 CA 1.006 6 residues pruned to eliminate duplicates Z: 6 6.337 1.497 0.681 0.550 1.000 0.600 CB 1.072 6 residues pruned to eliminate duplicates Z: 6 6.140 1.692 0.908 0.812 1.000 0.800 CB 0.648 Z: 121 68.231 2.155 0.883 0.578 0.917 0.633 CB 1.554 121 residues pruned to eliminate duplicates Z: 8 12.232 1.804 0.877 0.884 1.000 0.714 CB 0.986 8 residues pruned to eliminate duplicates Z: 14 9.634 2.003 0.553 0.333 0.769 0.462 CB 1.340 14 residues pruned to eliminate duplicates Z: 51 47.150 2.149 0.905 0.637 0.940 0.660 CB 1.524 51 residues pruned to eliminate duplicates Z: 8 4.064 1.590 -0.014 0.578 0.714 0.571 CB 1.272 Z: 19 10.054 1.935 0.353 0.308 0.889 0.556 CB 1.261 19 residues pruned to eliminate duplicates 6 1.777 1.797 0.075 0.284 0.400 0.400 CB 1.312 ? Z: 29 30.487 2.219 0.725 0.509 0.929 0.571 CB 1.605 29 residues pruned to eliminate duplicates Z: 9 17.225 1.987 0.705 0.698 1.000 0.875 CB 1.500 9 residues pruned to eliminate duplicates Z: 15 48.850 2.397 1.232 0.927 1.000 1.000 CB 1.709 15 residues pruned to eliminate duplicates Z: 19 11.776 1.858 0.466 0.503 0.778 0.444 CA 1.305 19 residues pruned to eliminate duplicates Z: 62 38.762 2.112 0.742 0.504 0.885 0.525 CB 1.518 62 residues pruned to eliminate duplicates Z: 49 55.517 2.372 0.991 0.589 0.896 0.708 CB 1.738 49 residues pruned to eliminate duplicates Z: 8 7.699 1.714 0.015 0.852 1.000 0.857 CB 1.238 8 residues pruned to eliminate duplicates Z: 27 16.717 1.916 0.540 0.366 0.923 0.538 CA 1.390 27 residues pruned to eliminate duplicates Z: 15 37.054 2.265 1.001 0.942 1.000 0.786 CA 1.515 15 residues pruned to eliminate duplicates Z: 10 13.043 1.906 0.787 0.808 0.889 0.556 CB 1.098 10 residues pruned to eliminate duplicates Z: 9 4.823 1.557 0.112 0.494 0.875 0.500 CB 1.131 8 residues pruned to eliminate duplicates Z: 6 8.897 1.749 0.395 0.807 1.000 0.800 CA 1.247 Z: 6 4.155 1.866 -0.354 0.659 1.000 0.400 CB 1.331 6 residues pruned to eliminate duplicates Z: 20 12.348 1.930 0.304 0.452 0.895 0.526 CA 1.321 20 residues pruned to eliminate duplicates Z: 13 47.578 2.457 1.050 0.939 1.000 0.917 CA 1.895 13 residues pruned to eliminate duplicates Z: 14 22.259 2.082 0.893 0.635 1.000 0.846 CB 1.380 14 residues pruned to eliminate duplicates Z: 8 7.348 1.761 0.582 0.754 0.714 0.143 CB 1.113 8 residues pruned to eliminate duplicates Z: 7 15.870 2.092 1.084 0.860 0.833 0.667 CA 1.311 7 residues pruned to eliminate duplicates Z: 6 4.175 1.294 0.621 0.775 1.000 0.600 N 0.698 Z: 7 2.164 1.332 0.369 0.232 0.667 0.167 CB 0.993 Z: 10 6.955 1.557 -0.041 0.863 1.000 0.778 CB 1.139 10 residues pruned to eliminate duplicates Z: 7 13.225 1.639 1.376 0.805 1.000 1.000 N 1.062 Z: 90 61.125 2.228 0.760 0.633 0.899 0.652 CB 1.622 90 residues pruned to eliminate duplicates Z: 9 5.383 1.552 0.252 0.744 0.750 0.500 CB 1.050 9 residues pruned to eliminate duplicates Z: 6 5.459 1.629 0.575 0.468 1.000 0.600 CB 0.984 6 residues pruned to eliminate duplicates Z: 30 24.404 2.233 0.787 0.433 0.793 0.483 CB 1.535 30 residues pruned to eliminate duplicates Z: 96 86.273 2.323 1.181 0.607 0.937 0.611 CB 1.685 96 residues pruned to eliminate duplicates Z: 6 4.137 1.492 0.378 0.414 0.800 0.400 O 1.231 Z: 7 2.330 1.774 -0.297 0.423 0.667 0.500 CB 1.239 7 residues pruned to eliminate duplicates Z: 25 26.905 2.309 0.854 0.448 0.875 0.583 CB 1.546 25 residues pruned to eliminate duplicates Z: 6 5.006 1.667 0.210 0.651 1.000 0.600 CB 0.964 6 residues pruned to eliminate duplicates Using tripeptides from previous cycle as seeds Z: 8 4.751 1.387 0.584 0.484 0.857 0.429 N 0.970 8 residues pruned to eliminate duplicates Z: 6 7.828 1.667 0.921 0.566 0.800 0.600 CB 1.282 6 residues pruned to eliminate duplicates Z: 10 6.960 1.531 0.400 0.575 0.889 0.444 CB 1.133 11 residues pruned to eliminate duplicates Z: 8 4.063 1.601 0.516 0.624 0.714 0.429 CB 0.788 8 residues pruned to eliminate duplicates Z: 15 5.179 1.545 0.317 0.367 0.786 0.571 CB 0.999 12 residues pruned to eliminate duplicates Z: 9 14.245 1.884 0.681 0.894 1.000 0.750 CB 1.141 9 residues pruned to eliminate duplicates Z: 10 13.790 1.819 0.775 0.815 0.889 0.889 CB 1.218 9 residues pruned to eliminate duplicates Z: 8 14.821 1.870 0.586 0.864 1.000 0.714 CB 1.385 9 residues pruned to eliminate duplicates Z: 9 12.463 1.897 0.458 0.904 1.000 0.750 CB 1.134 9 residues pruned to eliminate duplicates Z: 11 11.293 1.788 0.649 0.732 0.900 0.800 CB 1.093 11 residues pruned to eliminate duplicates Z: 11 16.301 1.802 0.829 0.733 1.000 0.800 CB 1.269 9 residues pruned to eliminate duplicates Z: 9 15.500 1.888 0.865 0.915 1.000 0.875 CB 1.100 9 residues pruned to eliminate duplicates Z: 12 11.659 1.706 0.649 0.667 0.909 0.818 CB 1.177 12 residues pruned to eliminate duplicates Z: 13 17.131 2.204 0.414 0.598 0.917 0.500 CB 1.577 13 residues pruned to eliminate duplicates Z: 16 19.174 2.156 0.646 0.479 0.933 0.467 CB 1.527 17 residues pruned to eliminate duplicates Z: 11 18.459 1.977 0.545 0.894 1.000 0.700 CB 1.371 11 residues pruned to eliminate duplicates Z: 17 17.677 2.141 0.460 0.521 0.938 0.562 CB 1.478 17 residues pruned to eliminate duplicates Z: 27 14.245 1.908 0.422 0.427 0.885 0.538 CB 1.255 40 residues pruned to eliminate duplicates Z: 11 19.906 1.965 0.783 0.880 1.000 0.600 CB 1.302 11 residues pruned to eliminate duplicates Z: 24 16.950 1.968 0.573 0.426 0.913 0.435 CB 1.350 23 residues pruned to eliminate duplicates Z: 12 16.185 2.080 0.611 0.675 0.818 0.545 CA 1.515 13 residues pruned to eliminate duplicates Z: 13 19.035 2.115 0.614 0.652 0.917 0.417 CB 1.524 13 residues pruned to eliminate duplicates Z: 16 18.792 2.155 0.433 0.533 0.933 0.400 CB 1.629 16 residues pruned to eliminate duplicates Z: 17 20.088 2.098 0.618 0.495 0.938 0.438 CB 1.587 17 residues pruned to eliminate duplicates Z: 17 18.998 2.111 0.577 0.509 0.938 0.562 CB 1.507 17 residues pruned to eliminate duplicates Z: 18 17.387 2.060 0.549 0.495 0.882 0.471 CB 1.506 18 residues pruned to eliminate duplicates Z: 17 17.256 2.097 0.574 0.442 0.875 0.438 CA 1.586 16 residues pruned to eliminate duplicates Z: 10 8.741 1.629 0.242 0.669 1.000 0.889 CB 1.232 10 residues pruned to eliminate duplicates Z: 10 7.644 1.628 0.202 0.673 0.889 0.556 CB 1.249 10 residues pruned to eliminate duplicates Z: 10 6.353 1.600 0.126 0.647 0.889 0.444 CB 1.153 10 residues pruned to eliminate duplicates Z: 18 7.046 1.547 0.137 0.511 0.941 0.706 CB 1.021 18 residues pruned to eliminate duplicates Z: 11 8.872 1.523 0.355 0.817 1.000 0.500 CB 1.032 11 residues pruned to eliminate duplicates Z: 22 9.726 1.641 0.322 0.448 0.857 0.524 CB 1.204 22 residues pruned to eliminate duplicates Z: 18 6.933 1.536 0.205 0.490 0.882 0.529 CB 1.040 19 residues pruned to eliminate duplicates Z: 10 8.804 1.505 0.408 0.817 1.000 0.667 CA 1.051 10 residues pruned to eliminate duplicates Z: 9 3.689 1.468 0.353 0.374 0.750 0.375 CB 1.001 9 residues pruned to eliminate duplicates Z: 17 6.487 1.560 0.194 0.504 0.812 0.438 CB 1.067 18 residues pruned to eliminate duplicates Z: 13 8.966 1.535 0.393 0.674 0.917 0.667 CB 1.125 13 residues pruned to eliminate duplicates Z: 10 4.192 1.391 0.558 0.389 1.000 0.556 CB 0.725 10 residues pruned to eliminate duplicates Z: 15 6.078 1.567 0.085 0.497 0.929 0.429 CB 1.031 15 residues pruned to eliminate duplicates Z: 17 16.495 1.934 0.439 0.509 1.000 0.750 CB 1.469 Z: 18 17.105 1.937 0.535 0.463 1.000 0.588 CB 1.449 17 residues pruned to eliminate duplicates Z: 9 9.919 1.640 0.515 0.720 0.875 0.500 CA 1.322 9 residues pruned to eliminate duplicates Z: 18 16.478 1.890 0.461 0.550 0.941 0.529 CB 1.464 18 residues pruned to eliminate duplicates Z: 18 17.891 1.936 0.535 0.551 0.941 0.647 CB 1.477 33 residues pruned to eliminate duplicates Z: 9 11.309 1.729 0.469 0.656 1.000 0.500 CB 1.362 10 residues pruned to eliminate duplicates Z: 10 11.303 1.930 0.242 0.626 1.000 0.667 CB 1.395 10 residues pruned to eliminate duplicates Z: 17 18.420 1.988 0.415 0.534 1.000 0.625 CB 1.584 17 residues pruned to eliminate duplicates Z: 7 6.498 2.061 0.463 0.443 0.667 0.333 CA 1.399 7 residues pruned to eliminate duplicates Z: 36 22.155 2.023 0.572 0.375 0.886 0.514 CB 1.519 53 residues pruned to eliminate duplicates Z: 24 17.783 2.054 0.679 0.354 0.870 0.565 CA 1.449 24 residues pruned to eliminate duplicates Z: 24 16.427 1.970 0.662 0.337 0.870 0.522 CB 1.437 31 residues pruned to eliminate duplicates Z: 20 17.218 2.096 0.744 0.334 0.895 0.632 CA 1.449 20 residues pruned to eliminate duplicates Z: 24 20.847 2.101 0.610 0.422 0.870 0.652 CB 1.603 24 residues pruned to eliminate duplicates Z: 19 17.163 2.099 0.907 0.319 0.889 0.556 CA 1.387 19 residues pruned to eliminate duplicates Z: 21 13.651 2.048 0.693 0.324 0.800 0.500 CA 1.336 21 residues pruned to eliminate duplicates Z: 18 17.215 2.118 0.835 0.328 0.882 0.529 CA 1.470 18 residues pruned to eliminate duplicates Z: 33 32.223 2.248 0.641 0.475 0.906 0.594 CB 1.746 33 residues pruned to eliminate duplicates Z: 22 14.520 2.043 0.723 0.317 0.810 0.619 CA 1.361 22 residues pruned to eliminate duplicates Z: 66 60.604 2.389 0.880 0.585 0.862 0.677 CB 1.790 66 residues pruned to eliminate duplicates Z: 21 16.689 2.053 0.687 0.361 0.850 0.650 CA 1.472 21 residues pruned to eliminate duplicates Z: 115 63.931 2.221 0.856 0.547 0.912 0.675 CB 1.520 115 residues pruned to eliminate duplicates Z: 30 32.242 2.292 0.964 0.548 0.759 0.552 CA 1.674 30 residues pruned to eliminate duplicates Z: 66 61.840 2.390 0.992 0.556 0.877 0.538 CB 1.740 66 residues pruned to eliminate duplicates Z: 28 34.021 2.307 0.933 0.591 0.815 0.593 CA 1.651 28 residues pruned to eliminate duplicates Z: 87 84.825 2.468 1.008 0.609 0.919 0.686 CB 1.813 87 residues pruned to eliminate duplicates Z: 60 68.331 2.421 0.979 0.583 0.949 0.525 CB 1.806 60 residues pruned to eliminate duplicates Z: 28 29.611 2.244 0.847 0.536 0.852 0.519 CA 1.557 28 residues pruned to eliminate duplicates Z: 59 65.242 2.435 0.985 0.586 0.914 0.690 CB 1.786 59 residues pruned to eliminate duplicates Z: 24 42.073 2.363 0.979 0.609 0.913 0.696 CA 1.853 24 residues pruned to eliminate duplicates Z: 26 35.848 2.386 0.900 0.547 0.880 0.520 CA 1.716 26 residues pruned to eliminate duplicates Z: 59 74.336 2.395 1.088 0.602 0.966 0.672 CA 1.836 59 residues pruned to eliminate duplicates Z: 23 33.277 2.418 0.889 0.593 0.864 0.500 CA 1.645 23 residues pruned to eliminate duplicates Z: 82 63.775 2.314 0.955 0.532 0.901 0.580 CB 1.685 82 residues pruned to eliminate duplicates Z: 41 37.756 2.291 0.774 0.479 0.900 0.550 CA 1.668 41 residues pruned to eliminate duplicates Z: 96 79.149 2.353 0.995 0.595 0.916 0.695 CB 1.725 96 residues pruned to eliminate duplicates Z: 89 75.646 2.406 0.964 0.584 0.909 0.591 CB 1.731 89 residues pruned to eliminate duplicates Z: 59 68.224 2.385 1.023 0.606 0.948 0.621 CB 1.771 59 residues pruned to eliminate duplicates Z: 86 84.511 2.454 0.949 0.613 0.941 0.576 CB 1.829 86 residues pruned to eliminate duplicates Z: 29 38.891 2.443 0.815 0.537 0.893 0.643 CB 1.790 29 residues pruned to eliminate duplicates Z: 86 85.969 2.445 1.001 0.616 0.929 0.612 CB 1.838 86 residues pruned to eliminate duplicates Z: 92 89.365 2.423 1.064 0.635 0.923 0.604 CB 1.788 92 residues pruned to eliminate duplicates Z: 79 66.413 2.309 0.985 0.554 0.949 0.641 CB 1.642 79 residues pruned to eliminate duplicates Z: 88 81.855 2.426 1.024 0.607 0.897 0.655 CB 1.801 88 residues pruned to eliminate duplicates Z: 93 60.576 2.250 0.880 0.538 0.891 0.554 CB 1.614 93 residues pruned to eliminate duplicates Z: 64 63.967 2.379 1.086 0.578 0.889 0.587 CB 1.695 64 residues pruned to eliminate duplicates Z: 59 67.358 2.412 1.136 0.594 0.914 0.569 CB 1.717 59 residues pruned to eliminate duplicates Z: 59 63.276 2.389 0.935 0.580 0.966 0.724 CB 1.724 59 residues pruned to eliminate duplicates Z: 77 63.428 2.300 0.961 0.507 0.934 0.513 CB 1.715 77 residues pruned to eliminate duplicates Z: 112 75.122 2.320 0.883 0.537 0.928 0.577 CB 1.695 112 residues pruned to eliminate duplicates Z: 38 48.646 2.444 0.825 0.571 0.946 0.622 CB 1.770 38 residues pruned to eliminate duplicates Z: 58 73.932 2.445 1.139 0.602 0.947 0.632 CB 1.794 58 residues pruned to eliminate duplicates Z: 63 63.206 2.375 0.968 0.578 0.919 0.629 CB 1.734 63 residues pruned to eliminate duplicates Z: 86 86.747 2.436 1.056 0.618 0.941 0.588 CB 1.786 86 residues pruned to eliminate duplicates Z: 95 90.491 2.385 1.127 0.631 0.926 0.617 CB 1.758 95 residues pruned to eliminate duplicates Z: 37 51.525 2.360 1.087 0.576 0.917 0.611 CB 1.768 37 residues pruned to eliminate duplicates Z: 75 59.407 2.302 0.982 0.516 0.878 0.541 CB 1.696 75 residues pruned to eliminate duplicates Z: 58 66.887 2.450 1.035 0.602 0.895 0.632 CB 1.802 58 residues pruned to eliminate duplicates Z: 88 83.640 2.433 1.038 0.603 0.931 0.713 CB 1.760 88 residues pruned to eliminate duplicates Z: 60 65.526 2.412 0.955 0.570 0.949 0.559 CB 1.782 60 residues pruned to eliminate duplicates Z: 61 65.402 2.404 1.065 0.579 0.917 0.600 CB 1.719 61 residues pruned to eliminate duplicates Z: 58 71.086 2.418 1.131 0.603 0.930 0.649 CB 1.781 58 residues pruned to eliminate duplicates Z: 65 59.022 2.319 1.086 0.554 0.891 0.516 CB 1.625 65 residues pruned to eliminate duplicates Z: 59 72.170 2.372 1.085 0.599 1.000 0.586 CB 1.744 59 residues pruned to eliminate duplicates Z: 115 80.870 2.280 1.017 0.588 0.921 0.570 CB 1.643 115 residues pruned to eliminate duplicates Z: 81 59.842 2.252 0.936 0.528 0.913 0.625 CB 1.635 81 residues pruned to eliminate duplicates Z: 61 64.679 2.390 1.033 0.560 0.950 0.517 CB 1.706 61 residues pruned to eliminate duplicates Z: 93 86.008 2.389 1.017 0.615 0.946 0.598 CB 1.766 93 residues pruned to eliminate duplicates Z: 67 63.164 2.352 1.002 0.560 0.924 0.561 CB 1.685 67 residues pruned to eliminate duplicates Z: 95 63.504 2.262 0.883 0.531 0.926 0.606 CB 1.612 101 residues pruned to eliminate duplicates Z: 18 53.782 2.266 1.439 0.936 1.000 0.412 CB 1.644 18 residues pruned to eliminate duplicates Z: 85 85.860 2.459 1.045 0.614 0.940 0.548 CB 1.778 85 residues pruned to eliminate duplicates Z: 56 73.639 2.426 1.158 0.630 0.945 0.582 CB 1.775 56 residues pruned to eliminate duplicates Z: 27 42.407 2.259 1.205 0.546 0.962 0.500 CB 1.660 27 residues pruned to eliminate duplicates Z: 97 86.523 2.377 1.118 0.611 0.906 0.573 CB 1.742 97 residues pruned to eliminate duplicates Z: 89 85.899 2.432 1.019 0.603 0.943 0.580 CB 1.793 89 residues pruned to eliminate duplicates Z: 71 72.621 2.366 1.052 0.634 0.900 0.614 CB 1.751 71 residues pruned to eliminate duplicates Z: 65 71.673 2.410 1.082 0.626 0.922 0.734 CB 1.721 65 residues pruned to eliminate duplicates Z: 100 82.511 2.375 1.044 0.616 0.889 0.606 CB 1.723 100 residues pruned to eliminate duplicates Z: 32 50.892 2.406 1.032 0.632 0.935 0.581 CB 1.765 32 residues pruned to eliminate duplicates Z: 44 44.140 2.209 0.912 0.596 0.907 0.465 CB 1.603 44 residues pruned to eliminate duplicates Z: 74 77.076 2.428 1.076 0.601 0.932 0.507 CB 1.745 74 residues pruned to eliminate duplicates Z: 32 50.255 2.435 0.997 0.648 0.935 0.677 CA 1.729 32 residues pruned to eliminate duplicates Z: 32 53.051 2.432 1.035 0.648 0.935 0.742 CA 1.792 32 residues pruned to eliminate duplicates Z: 33 44.908 2.376 1.014 0.584 0.906 0.531 CA 1.689 33 residues pruned to eliminate duplicates Z: 32 48.161 2.436 0.956 0.636 0.903 0.613 CA 1.769 32 residues pruned to eliminate duplicates Z: 44 46.644 2.229 0.984 0.589 0.884 0.535 CB 1.672 44 residues pruned to eliminate duplicates Z: 41 50.283 2.225 1.136 0.657 0.900 0.625 CA 1.607 41 residues pruned to eliminate duplicates Z: 95 89.129 2.383 1.125 0.632 0.936 0.606 CB 1.713 95 residues pruned to eliminate duplicates Z: 46 48.285 2.186 1.038 0.600 0.911 0.556 CA 1.611 46 residues pruned to eliminate duplicates Z: 38 49.540 2.291 1.069 0.669 0.892 0.514 CA 1.649 38 residues pruned to eliminate duplicates Z: 89 83.487 2.432 1.042 0.618 0.920 0.614 CB 1.742 89 residues pruned to eliminate duplicates Z: 122 74.058 2.245 0.973 0.559 0.893 0.537 CB 1.608 122 residues pruned to eliminate duplicates Z: 68 78.288 2.431 1.075 0.608 0.955 0.582 CB 1.791 68 residues pruned to eliminate duplicates Z: 37 42.315 2.266 0.950 0.586 0.861 0.583 CB 1.706 37 residues pruned to eliminate duplicates Z: 157 82.082 2.182 1.010 0.563 0.910 0.564 CB 1.549 204 residues pruned to eliminate duplicates Z: 6 3.573 1.811 0.301 0.236 0.800 0.200 CA 1.152 6 residues pruned to eliminate duplicates Z: 81 73.693 2.340 0.971 0.626 0.975 0.538 CB 1.627 81 residues pruned to eliminate duplicates Z: 122 85.807 2.364 0.967 0.609 0.917 0.554 CB 1.650 122 residues pruned to eliminate duplicates Z: 12 15.883 1.963 0.874 0.674 0.909 0.364 CA 1.220 12 residues pruned to eliminate duplicates Z: 86 76.782 2.373 1.011 0.610 0.953 0.529 CB 1.651 86 residues pruned to eliminate duplicates Z: 87 73.048 2.360 0.908 0.620 0.965 0.640 CB 1.619 87 residues pruned to eliminate duplicates Z: 88 72.678 2.346 0.940 0.615 0.966 0.621 CB 1.590 88 residues pruned to eliminate duplicates Z: 144 92.624 2.376 0.919 0.612 0.930 0.545 CB 1.643 144 residues pruned to eliminate duplicates Z: 122 91.301 2.431 0.879 0.604 0.934 0.669 CB 1.762 122 residues pruned to eliminate duplicates Z: 84 72.651 2.390 0.908 0.619 0.940 0.602 CB 1.662 84 residues pruned to eliminate duplicates Z: 70 65.236 2.314 0.936 0.614 0.928 0.681 CB 1.696 70 residues pruned to eliminate duplicates Z: 83 71.931 2.368 0.938 0.635 0.927 0.622 CB 1.646 83 residues pruned to eliminate duplicates Z: 85 74.501 2.382 0.922 0.642 0.929 0.619 CB 1.674 85 residues pruned to eliminate duplicates Z: 69 60.632 2.297 0.946 0.604 0.941 0.588 CB 1.584 69 residues pruned to eliminate duplicates Z: 84 70.375 2.385 0.829 0.625 0.952 0.614 CB 1.653 84 residues pruned to eliminate duplicates Z: 73 64.713 2.355 0.972 0.611 0.903 0.625 CB 1.638 73 residues pruned to eliminate duplicates Z: 82 71.683 2.389 0.934 0.632 0.926 0.605 CB 1.645 82 residues pruned to eliminate duplicates Z: 66 57.071 2.280 0.860 0.604 0.923 0.585 CB 1.638 66 residues pruned to eliminate duplicates Z: 86 75.522 2.390 0.898 0.641 0.941 0.682 CB 1.681 86 residues pruned to eliminate duplicates Z: 83 72.618 2.381 0.863 0.651 0.939 0.622 CB 1.672 83 residues pruned to eliminate duplicates Z: 57 58.566 2.301 0.892 0.658 0.964 0.607 CB 1.610 57 residues pruned to eliminate duplicates Z: 84 76.360 2.404 0.966 0.617 0.940 0.639 CB 1.689 84 residues pruned to eliminate duplicates Z: 116 93.952 2.425 1.001 0.625 0.939 0.609 CB 1.709 116 residues pruned to eliminate duplicates Z: 123 94.926 2.429 0.967 0.622 0.926 0.656 CB 1.730 123 residues pruned to eliminate duplicates Z: 58 58.975 2.290 0.850 0.649 1.000 0.632 CB 1.605 58 residues pruned to eliminate duplicates Z: 86 78.185 2.384 1.041 0.618 0.941 0.659 CB 1.656 86 residues pruned to eliminate duplicates Z: 87 75.474 2.341 0.975 0.617 0.953 0.512 CB 1.653 87 residues pruned to eliminate duplicates Z: 71 63.199 2.321 0.894 0.610 0.957 0.600 CB 1.617 71 residues pruned to eliminate duplicates Z: 87 76.865 2.378 0.976 0.615 0.942 0.628 CB 1.680 87 residues pruned to eliminate duplicates Z: 112 80.201 2.397 0.859 0.578 0.928 0.649 CB 1.708 112 residues pruned to eliminate duplicates Z: 66 61.579 2.297 0.871 0.646 0.954 0.723 CB 1.625 66 residues pruned to eliminate duplicates Z: 84 77.686 2.389 0.947 0.650 0.952 0.699 CB 1.674 84 residues pruned to eliminate duplicates Z: 59 53.063 2.276 0.851 0.619 0.931 0.672 CB 1.587 59 residues pruned to eliminate duplicates Z: 109 95.918 2.408 1.050 0.643 0.963 0.630 CB 1.698 109 residues pruned to eliminate duplicates Z: 69 66.461 2.330 0.859 0.613 0.985 0.618 CB 1.697 69 residues pruned to eliminate duplicates Z: 82 83.123 2.400 1.039 0.663 0.951 0.691 CB 1.707 82 residues pruned to eliminate duplicates Z: 84 79.177 2.395 0.931 0.661 0.964 0.639 CB 1.680 84 residues pruned to eliminate duplicates Z: 69 71.793 2.339 0.974 0.626 0.985 0.662 CB 1.699 69 residues pruned to eliminate duplicates Z: 84 73.026 2.374 0.900 0.641 0.952 0.614 CB 1.636 84 residues pruned to eliminate duplicates Z: 144 96.065 2.406 0.963 0.593 0.916 0.552 CB 1.698 144 residues pruned to eliminate duplicates Z: 83 80.852 2.395 0.990 0.660 0.963 0.585 CB 1.676 83 residues pruned to eliminate duplicates Z: 114 83.929 2.362 0.977 0.608 0.929 0.593 CB 1.643 114 residues pruned to eliminate duplicates Z: 122 88.530 2.383 0.955 0.588 0.926 0.612 CB 1.716 122 residues pruned to eliminate duplicates Z: 84 74.674 2.381 0.966 0.638 0.940 0.675 CB 1.637 84 residues pruned to eliminate duplicates Z: 89 73.297 2.369 0.927 0.594 0.932 0.545 CB 1.678 89 residues pruned to eliminate duplicates Z: 19 31.097 2.313 1.066 0.527 0.889 0.667 CB 1.680 19 residues pruned to eliminate duplicates Z: 69 65.651 2.321 0.961 0.601 0.956 0.662 CB 1.661 69 residues pruned to eliminate duplicates Z: 67 52.717 2.231 0.719 0.601 0.924 0.682 CB 1.663 67 residues pruned to eliminate duplicates Z: 85 77.790 2.365 1.041 0.635 0.940 0.655 CB 1.648 85 residues pruned to eliminate duplicates Z: 86 75.697 2.370 0.965 0.631 0.941 0.635 CB 1.656 86 residues pruned to eliminate duplicates Z: 19 38.766 2.404 0.970 0.519 1.000 0.556 CB 1.894 26 residues pruned to eliminate duplicates Z: 7 7.248 1.833 1.132 0.338 0.833 0.167 CA 1.085 7 residues pruned to eliminate duplicates Z: 85 79.230 2.478 1.022 0.549 0.917 0.643 CB 1.794 85 residues pruned to eliminate duplicates Z: 123 89.595 2.407 0.957 0.604 0.934 0.631 CB 1.669 123 residues pruned to eliminate duplicates Z: 43 40.979 2.302 0.829 0.535 0.881 0.548 CB 1.648 43 residues pruned to eliminate duplicates Z: 87 81.302 2.371 0.985 0.654 0.953 0.709 CB 1.692 87 residues pruned to eliminate duplicates Z: 76 72.503 2.436 1.043 0.580 0.907 0.680 CB 1.717 76 residues pruned to eliminate duplicates Z: 122 89.509 2.415 0.955 0.612 0.917 0.636 CB 1.690 122 residues pruned to eliminate duplicates Z: 123 80.514 2.397 0.831 0.589 0.902 0.631 CB 1.692 123 residues pruned to eliminate duplicates Z: 122 92.246 2.417 0.948 0.616 0.926 0.587 CB 1.724 122 residues pruned to eliminate duplicates Z: 122 87.371 2.412 0.927 0.590 0.909 0.603 CB 1.725 122 residues pruned to eliminate duplicates Z: 139 86.999 2.375 0.883 0.597 0.899 0.601 CB 1.680 139 residues pruned to eliminate duplicates Z: 88 73.981 2.406 0.929 0.577 0.920 0.552 CB 1.726 88 residues pruned to eliminate duplicates Z: 61 57.168 2.345 0.931 0.579 0.933 0.583 CB 1.619 61 residues pruned to eliminate duplicates Z: 89 68.862 2.380 0.908 0.568 0.909 0.636 CB 1.665 89 residues pruned to eliminate duplicates Z: 87 70.167 2.373 0.947 0.563 0.907 0.616 CB 1.699 87 residues pruned to eliminate duplicates Z: 91 76.310 2.402 1.014 0.587 0.889 0.622 CB 1.720 91 residues pruned to eliminate duplicates Z: 92 74.247 2.404 1.002 0.576 0.890 0.604 CB 1.689 92 residues pruned to eliminate duplicates Z: 112 89.126 2.402 0.976 0.611 0.919 0.631 CB 1.747 112 residues pruned to eliminate duplicates Z: 88 73.016 2.433 0.939 0.589 0.897 0.621 CB 1.700 88 residues pruned to eliminate duplicates Z: 61 56.678 2.375 0.987 0.561 0.900 0.617 CB 1.624 61 residues pruned to eliminate duplicates Z: 67 54.116 2.360 0.883 0.543 0.924 0.621 CB 1.555 67 residues pruned to eliminate duplicates Z: 60 56.910 2.400 0.944 0.579 0.898 0.542 CB 1.639 60 residues pruned to eliminate duplicates Z: 60 53.693 2.305 0.977 0.521 0.932 0.559 CB 1.612 60 residues pruned to eliminate duplicates Z: 62 54.152 2.344 0.881 0.565 0.902 0.623 CB 1.638 62 residues pruned to eliminate duplicates Z: 57 40.126 2.290 0.803 0.456 0.857 0.482 CB 1.584 57 residues pruned to eliminate duplicates Z: 90 75.164 2.436 0.898 0.582 0.921 0.596 CB 1.728 90 residues pruned to eliminate duplicates Z: 59 58.829 2.383 0.937 0.569 0.966 0.586 CB 1.622 59 residues pruned to eliminate duplicates Z: 30 32.512 2.288 1.022 0.482 0.862 0.552 CB 1.542 30 residues pruned to eliminate duplicates Z: 59 58.331 2.376 0.926 0.580 0.948 0.603 CB 1.634 59 residues pruned to eliminate duplicates Z: 61 56.036 2.374 0.890 0.574 0.900 0.550 CB 1.667 61 residues pruned to eliminate duplicates Z: 50 55.325 2.393 1.004 0.592 0.939 0.653 CB 1.607 50 residues pruned to eliminate duplicates Z: 61 58.770 2.373 0.917 0.565 0.950 0.600 CB 1.649 61 residues pruned to eliminate duplicates Z: 142 92.537 2.387 0.941 0.603 0.915 0.610 CB 1.668 142 residues pruned to eliminate duplicates Z: 63 53.078 2.344 0.897 0.582 0.871 0.629 CB 1.609 63 residues pruned to eliminate duplicates Z: 144 97.218 2.383 0.980 0.602 0.923 0.580 CB 1.694 144 residues pruned to eliminate duplicates Z: 112 88.619 2.386 0.947 0.635 0.946 0.640 CB 1.686 112 residues pruned to eliminate duplicates Z: 28 41.359 2.384 1.157 0.525 0.926 0.630 CB 1.631 28 residues pruned to eliminate duplicates Z: 61 57.609 2.336 1.016 0.546 0.933 0.583 CB 1.618 61 residues pruned to eliminate duplicates Z: 27 44.949 2.325 1.226 0.579 0.962 0.577 CB 1.642 27 residues pruned to eliminate duplicates Z: 85 64.229 2.351 1.065 0.555 0.869 0.512 CB 1.575 85 residues pruned to eliminate duplicates Z: 27 43.164 2.409 1.187 0.549 0.962 0.538 CB 1.593 27 residues pruned to eliminate duplicates Z: 145 94.119 2.384 0.894 0.612 0.938 0.611 CB 1.666 145 residues pruned to eliminate duplicates Z: 27 41.778 2.333 1.086 0.575 0.962 0.538 CB 1.629 27 residues pruned to eliminate duplicates Z: 112 90.049 2.398 0.998 0.633 0.928 0.559 CB 1.697 112 residues pruned to eliminate duplicates Z: 88 76.953 2.412 0.960 0.583 0.943 0.529 CB 1.710 88 residues pruned to eliminate duplicates Z: 97 76.272 2.401 1.033 0.577 0.917 0.594 CB 1.616 97 residues pruned to eliminate duplicates Z: 90 72.325 2.398 0.963 0.607 0.921 0.562 CB 1.598 90 residues pruned to eliminate duplicates Z: 34 50.851 2.439 1.100 0.573 0.909 0.515 CB 1.771 34 residues pruned to eliminate duplicates Z: 86 73.258 2.431 0.994 0.580 0.894 0.635 CB 1.698 86 residues pruned to eliminate duplicates Z: 85 71.652 2.369 0.890 0.633 0.905 0.631 CB 1.703 85 residues pruned to eliminate duplicates Z: 31 39.172 2.405 0.828 0.576 0.933 0.633 CB 1.620 31 residues pruned to eliminate duplicates Z: 31 51.435 2.529 0.898 0.622 0.933 0.633 CA 1.869 31 residues pruned to eliminate duplicates Z: 34 51.456 2.415 1.005 0.608 0.909 0.576 CB 1.837 34 residues pruned to eliminate duplicates Z: 34 46.508 2.473 0.858 0.589 0.909 0.606 CB 1.781 34 residues pruned to eliminate duplicates Z: 32 49.010 2.431 1.136 0.589 0.903 0.645 CB 1.723 32 residues pruned to eliminate duplicates Z: 30 47.290 2.512 0.953 0.613 0.897 0.586 CB 1.794 30 residues pruned to eliminate duplicates Z: 32 50.717 2.491 1.001 0.637 0.903 0.677 CB 1.779 32 residues pruned to eliminate duplicates Z: 87 74.733 2.396 0.925 0.629 0.907 0.570 CB 1.707 87 residues pruned to eliminate duplicates Z: 85 74.719 2.385 0.956 0.634 0.917 0.619 CB 1.682 85 residues pruned to eliminate duplicates Z: 83 74.252 2.358 0.984 0.631 0.939 0.598 CB 1.650 83 residues pruned to eliminate duplicates Z: 64 66.387 2.370 0.926 0.678 0.905 0.698 CB 1.718 64 residues pruned to eliminate duplicates Z: 83 72.260 2.378 0.920 0.631 0.915 0.524 CB 1.690 83 residues pruned to eliminate duplicates Z: 84 71.840 2.388 0.898 0.619 0.940 0.627 CB 1.654 84 residues pruned to eliminate duplicates Z: 82 65.145 2.380 0.786 0.616 0.901 0.580 CB 1.693 82 residues pruned to eliminate duplicates Z: 29 55.198 2.531 1.122 0.643 0.929 0.643 CB 1.831 29 residues pruned to eliminate duplicates Z: 32 51.396 2.434 1.002 0.612 0.968 0.452 CB 1.760 32 residues pruned to eliminate duplicates Z: 71 83.358 2.476 1.121 0.649 0.957 0.557 CB 1.725 71 residues pruned to eliminate duplicates Z: 18 24.214 2.297 0.918 0.437 0.882 0.471 CB 1.613 18 residues pruned to eliminate duplicates Z: 23 17.008 2.242 0.433 0.389 0.727 0.364 CB 1.747 23 residues pruned to eliminate duplicates Z: 17 18.819 2.060 0.580 0.463 1.000 0.438 CB 1.502 17 residues pruned to eliminate duplicates Z: 14 27.273 2.203 0.706 0.601 1.000 0.538 CB 1.828 14 residues pruned to eliminate duplicates Z: 19 16.312 2.074 0.659 0.401 0.778 0.500 CB 1.594 19 residues pruned to eliminate duplicates Z: 18 18.107 2.046 0.728 0.420 0.882 0.471 CB 1.531 18 residues pruned to eliminate duplicates Z: 17 19.334 2.085 0.693 0.496 0.875 0.688 CB 1.572 17 residues pruned to eliminate duplicates Z: 22 18.691 2.091 0.574 0.385 0.952 0.429 CB 1.471 22 residues pruned to eliminate duplicates Z: 45 27.014 2.070 0.634 0.441 0.864 0.477 CB 1.482 45 residues pruned to eliminate duplicates Z: 18 21.661 2.037 0.924 0.440 0.882 0.353 CA 1.616 18 residues pruned to eliminate duplicates Z: 21 19.972 2.170 0.635 0.405 0.900 0.450 CB 1.545 21 residues pruned to eliminate duplicates Z: 19 17.194 2.094 0.629 0.407 0.889 0.389 CB 1.474 19 residues pruned to eliminate duplicates Z: 17 20.977 2.051 0.879 0.492 0.875 0.375 CB 1.567 17 residues pruned to eliminate duplicates Z: 23 18.167 2.007 0.696 0.372 0.909 0.500 CB 1.436 23 residues pruned to eliminate duplicates Z: 25 21.888 2.173 0.684 0.452 0.792 0.375 CA 1.621 23 residues pruned to eliminate duplicates Z: 7 4.461 1.411 0.395 0.453 0.833 0.333 CA 1.165 7 residues pruned to eliminate duplicates Z: 38 27.530 2.206 0.674 0.459 0.865 0.595 CB 1.478 38 residues pruned to eliminate duplicates Z: 74 36.187 2.115 0.608 0.454 0.890 0.562 CB 1.466 74 residues pruned to eliminate duplicates Z: 10 13.866 2.141 0.806 0.499 0.889 0.667 CA 1.346 10 residues pruned to eliminate duplicates Z: 21 22.867 2.239 0.690 0.495 0.950 0.550 CB 1.430 21 residues pruned to eliminate duplicates Z: 32 26.073 2.207 0.827 0.399 0.871 0.581 CB 1.484 32 residues pruned to eliminate duplicates Z: 36 27.930 2.253 0.598 0.466 0.886 0.571 CB 1.532 36 residues pruned to eliminate duplicates Z: 11 12.162 2.198 0.563 0.413 0.900 0.500 CB 1.362 11 residues pruned to eliminate duplicates Z: 50 25.774 2.079 0.546 0.426 0.857 0.429 CB 1.444 50 residues pruned to eliminate duplicates Z: 34 24.531 2.193 0.556 0.475 0.818 0.576 CB 1.569 34 residues pruned to eliminate duplicates Z: 48 30.941 2.168 0.643 0.437 0.851 0.553 CB 1.588 48 residues pruned to eliminate duplicates Z: 15 9.838 2.038 0.611 0.560 0.714 0.643 CB 1.058 15 residues pruned to eliminate duplicates Z: 78 31.907 2.048 0.617 0.405 0.844 0.558 CB 1.437 78 residues pruned to eliminate duplicates Z: 113 54.676 2.187 0.680 0.495 0.902 0.607 CB 1.567 113 residues pruned to eliminate duplicates Z: 33 18.032 2.038 0.523 0.403 0.875 0.656 CB 1.299 33 residues pruned to eliminate duplicates Z: 32 30.775 2.214 0.788 0.482 0.935 0.645 CB 1.521 32 residues pruned to eliminate duplicates Z: 213 96.258 2.282 0.832 0.560 0.920 0.623 CB 1.621 213 residues pruned to eliminate duplicates Z: 74 45.905 2.182 0.737 0.479 0.932 0.658 CB 1.555 74 residues pruned to eliminate duplicates Z: 60 41.260 2.171 0.695 0.530 0.915 0.695 CB 1.549 60 residues pruned to eliminate duplicates Z: 23 25.974 2.138 0.828 0.485 0.909 0.591 CA 1.582 23 residues pruned to eliminate duplicates Z: 34 25.748 2.166 0.757 0.427 0.818 0.576 CB 1.552 34 residues pruned to eliminate duplicates Z: 21 28.565 2.199 0.808 0.549 0.900 0.700 CB 1.703 21 residues pruned to eliminate duplicates Z: 35 38.790 2.220 0.680 0.628 0.941 0.735 CB 1.679 35 residues pruned to eliminate duplicates Z: 65 44.687 2.156 0.796 0.495 0.953 0.594 CB 1.521 65 residues pruned to eliminate duplicates Z: 86 47.435 2.170 0.704 0.501 0.894 0.612 CB 1.555 86 residues pruned to eliminate duplicates Z: 36 38.068 2.203 0.668 0.625 0.943 0.686 CA 1.651 36 residues pruned to eliminate duplicates Z: 144 69.010 2.231 0.726 0.526 0.930 0.594 CB 1.569 144 residues pruned to eliminate duplicates Z: 226 89.237 2.238 0.774 0.548 0.920 0.596 CB 1.554 226 residues pruned to eliminate duplicates Z: 35 39.288 2.173 0.732 0.660 0.941 0.706 CB 1.639 35 residues pruned to eliminate duplicates Z: 64 38.529 2.130 0.720 0.467 0.921 0.619 CB 1.488 280 residues pruned to eliminate duplicates Z: 121 65.409 2.237 0.748 0.532 0.933 0.633 CB 1.585 121 residues pruned to eliminate duplicates Z: 36 39.160 2.174 0.796 0.634 0.914 0.657 CB 1.635 36 residues pruned to eliminate duplicates Z: 65 35.412 2.087 0.708 0.465 0.891 0.531 CB 1.446 65 residues pruned to eliminate duplicates Z: 64 41.358 2.145 0.686 0.506 0.937 0.651 CB 1.529 64 residues pruned to eliminate duplicates Z: 89 43.747 2.114 0.791 0.433 0.864 0.545 CB 1.528 89 residues pruned to eliminate duplicates Z: 61 40.170 2.166 0.722 0.534 0.900 0.683 CB 1.493 61 residues pruned to eliminate duplicates Z: 120 66.863 2.247 0.799 0.531 0.941 0.571 CB 1.562 120 residues pruned to eliminate duplicates Z: 144 67.200 2.229 0.758 0.530 0.895 0.587 CB 1.556 144 residues pruned to eliminate duplicates Z: 36 38.757 2.229 0.766 0.618 0.971 0.629 CB 1.531 36 residues pruned to eliminate duplicates Z: 64 37.966 2.116 0.645 0.503 0.952 0.603 CB 1.438 64 residues pruned to eliminate duplicates Z: 46 35.834 2.128 0.596 0.557 0.956 0.600 CB 1.557 46 residues pruned to eliminate duplicates Z: 50 41.895 2.153 0.711 0.565 0.959 0.571 CB 1.591 50 residues pruned to eliminate duplicates Z: 60 45.525 2.229 0.731 0.554 0.898 0.661 CB 1.622 60 residues pruned to eliminate duplicates Z: 74 40.611 2.162 0.733 0.461 0.863 0.507 CB 1.529 74 residues pruned to eliminate duplicates Z: 206 101.105 2.301 0.875 0.573 0.927 0.571 CB 1.645 206 residues pruned to eliminate duplicates Z: 125 64.547 2.250 0.745 0.513 0.919 0.613 CB 1.584 125 residues pruned to eliminate duplicates Z: 210 100.611 2.311 0.833 0.578 0.933 0.632 CB 1.634 210 residues pruned to eliminate duplicates Z: 73 44.325 2.142 0.740 0.474 0.944 0.597 CB 1.523 73 residues pruned to eliminate duplicates Z: 28 16.751 2.056 0.633 0.317 0.778 0.444 CB 1.510 28 residues pruned to eliminate duplicates Z: 84 52.887 2.224 0.747 0.496 0.952 0.566 CB 1.577 84 residues pruned to eliminate duplicates Z: 18 14.122 1.963 0.606 0.380 0.882 0.529 CB 1.399 18 residues pruned to eliminate duplicates Z: 65 44.199 2.137 0.859 0.494 0.906 0.656 CB 1.544 65 residues pruned to eliminate duplicates Z: 64 36.313 2.137 0.687 0.470 0.857 0.619 CB 1.526 64 residues pruned to eliminate duplicates Z: 160 81.971 2.293 0.812 0.539 0.931 0.610 CB 1.617 160 residues pruned to eliminate duplicates Z: 31 19.420 1.996 0.783 0.258 0.867 0.400 CA 1.516 31 residues pruned to eliminate duplicates Z: 163 93.856 2.304 0.898 0.574 0.951 0.605 CB 1.652 163 residues pruned to eliminate duplicates Z: 132 66.434 2.240 0.743 0.523 0.924 0.573 CB 1.573 132 residues pruned to eliminate duplicates Z: 70 39.064 2.137 0.717 0.453 0.899 0.609 CB 1.497 70 residues pruned to eliminate duplicates Z: 143 89.141 2.333 0.901 0.588 0.930 0.620 CB 1.667 143 residues pruned to eliminate duplicates Z: 17 12.039 2.039 0.639 0.216 0.812 0.500 CB 1.549 17 residues pruned to eliminate duplicates Z: 17 11.524 2.025 0.674 0.256 0.750 0.500 CB 1.498 17 residues pruned to eliminate duplicates Z: 73 40.875 2.146 0.721 0.443 0.917 0.556 CB 1.509 73 residues pruned to eliminate duplicates Z: 32 23.195 2.073 0.675 0.303 0.935 0.516 CB 1.597 32 residues pruned to eliminate duplicates Z: 159 92.497 2.319 0.881 0.588 0.949 0.620 CB 1.633 159 residues pruned to eliminate duplicates Z: 19 15.599 2.243 0.780 0.231 0.778 0.389 CB 1.619 19 residues pruned to eliminate duplicates Z: 154 93.254 2.330 0.930 0.597 0.922 0.641 CB 1.658 154 residues pruned to eliminate duplicates Z: 22 13.332 1.905 0.742 0.242 0.810 0.429 CB 1.459 22 residues pruned to eliminate duplicates Z: 17 16.057 2.035 0.674 0.324 0.938 0.625 CB 1.525 17 residues pruned to eliminate duplicates Z: 158 71.760 2.237 0.764 0.517 0.898 0.611 CB 1.589 158 residues pruned to eliminate duplicates Z: 166 83.365 2.299 0.824 0.562 0.897 0.618 CB 1.624 166 residues pruned to eliminate duplicates Z: 93 48.749 2.157 0.725 0.480 0.902 0.630 CB 1.545 93 residues pruned to eliminate duplicates Z: 30 31.599 2.250 0.881 0.552 0.897 0.586 CB 1.470 30 residues pruned to eliminate duplicates Z: 187 98.491 2.297 0.822 0.602 0.957 0.656 CB 1.637 187 residues pruned to eliminate duplicates Z: 153 96.317 2.354 0.920 0.610 0.941 0.625 CB 1.655 153 residues pruned to eliminate duplicates Z: 147 86.236 2.318 0.848 0.583 0.911 0.623 CB 1.690 147 residues pruned to eliminate duplicates Z: 91 74.860 2.401 0.838 0.597 0.933 0.589 CB 1.745 91 residues pruned to eliminate duplicates Z: 106 79.436 2.343 0.956 0.599 0.924 0.600 CB 1.666 106 residues pruned to eliminate duplicates Z: 62 52.479 2.320 0.754 0.562 0.951 0.607 CB 1.635 62 residues pruned to eliminate duplicates Z: 191 99.772 2.289 0.891 0.588 0.942 0.653 CB 1.632 191 residues pruned to eliminate duplicates Z: 138 77.583 2.299 0.775 0.559 0.920 0.620 CB 1.667 138 residues pruned to eliminate duplicates Z: 76 49.913 2.272 0.703 0.497 0.933 0.480 CB 1.601 76 residues pruned to eliminate duplicates Z: 22 31.642 2.350 0.727 0.605 0.905 0.524 CB 1.702 22 residues pruned to eliminate duplicates Z: 74 50.626 2.266 0.749 0.512 0.918 0.534 CB 1.609 74 residues pruned to eliminate duplicates Z: 143 89.166 2.329 0.965 0.591 0.901 0.577 CB 1.662 143 residues pruned to eliminate duplicates Z: 165 87.853 2.323 0.813 0.571 0.927 0.616 CB 1.641 165 residues pruned to eliminate duplicates Z: 25 36.704 2.298 0.879 0.581 0.958 0.625 CA 1.675 25 residues pruned to eliminate duplicates Z: 157 90.931 2.330 0.890 0.599 0.929 0.615 CB 1.619 157 residues pruned to eliminate duplicates Z: 69 49.490 2.297 0.817 0.524 0.882 0.559 CB 1.591 69 residues pruned to eliminate duplicates Z: 122 74.107 2.301 0.880 0.555 0.901 0.620 CB 1.639 122 residues pruned to eliminate duplicates Z: 104 67.010 2.300 0.861 0.518 0.913 0.544 CB 1.660 104 residues pruned to eliminate duplicates Z: 90 65.387 2.359 0.826 0.548 0.910 0.562 CB 1.687 90 residues pruned to eliminate duplicates Z: 155 86.708 2.326 0.842 0.581 0.909 0.630 CB 1.659 155 residues pruned to eliminate duplicates Z: 120 73.319 2.248 0.814 0.554 0.983 0.672 CB 1.590 120 residues pruned to eliminate duplicates Z: 139 91.141 2.367 0.888 0.613 0.928 0.594 CB 1.681 139 residues pruned to eliminate duplicates Z: 137 75.775 2.267 0.776 0.552 0.941 0.588 CB 1.630 137 residues pruned to eliminate duplicates Z: 90 77.238 2.385 0.963 0.604 0.933 0.674 CB 1.699 90 residues pruned to eliminate duplicates Z: 196 92.704 2.262 0.888 0.573 0.913 0.651 CB 1.587 196 residues pruned to eliminate duplicates Z: 117 69.689 2.294 0.874 0.525 0.914 0.612 CB 1.607 117 residues pruned to eliminate duplicates Z: 71 57.221 2.319 0.908 0.524 0.943 0.614 CB 1.601 71 residues pruned to eliminate duplicates Z: 201 91.913 2.270 0.844 0.562 0.915 0.605 CB 1.597 201 residues pruned to eliminate duplicates Z: 35 44.641 2.357 0.875 0.582 0.971 0.588 CB 1.649 35 residues pruned to eliminate duplicates Z: 85 85.644 2.383 1.044 0.684 0.940 0.667 CB 1.724 85 residues pruned to eliminate duplicates Z: 54 65.767 2.430 0.994 0.610 0.943 0.623 CB 1.781 54 residues pruned to eliminate duplicates Z: 121 63.253 2.250 0.796 0.482 0.933 0.558 CB 1.560 121 residues pruned to eliminate duplicates Z: 79 51.104 2.264 0.769 0.484 0.923 0.551 CB 1.590 79 residues pruned to eliminate duplicates Z: 71 57.950 2.312 0.904 0.532 0.957 0.571 CB 1.593 71 residues pruned to eliminate duplicates Z: 27 36.259 2.289 0.853 0.546 0.962 0.538 CB 1.667 27 residues pruned to eliminate duplicates Z: 125 87.487 2.368 0.885 0.635 0.927 0.645 CB 1.671 125 residues pruned to eliminate duplicates Z: 80 65.384 2.363 0.834 0.571 0.937 0.557 CB 1.692 80 residues pruned to eliminate duplicates Z: 61 56.099 2.340 0.804 0.560 0.983 0.617 CB 1.646 61 residues pruned to eliminate duplicates Z: 65 70.318 2.436 0.965 0.626 0.922 0.656 CB 1.769 65 residues pruned to eliminate duplicates Z: 114 86.318 2.372 0.939 0.626 0.920 0.611 CB 1.704 114 residues pruned to eliminate duplicates Z: 134 90.728 2.367 0.879 0.616 0.940 0.632 CB 1.686 134 residues pruned to eliminate duplicates Z: 85 68.649 2.384 0.903 0.556 0.905 0.619 CB 1.728 85 residues pruned to eliminate duplicates Z: 113 88.633 2.370 0.966 0.624 0.946 0.616 CB 1.690 113 residues pruned to eliminate duplicates Z: 201 100.100 2.303 0.898 0.577 0.930 0.620 CB 1.616 201 residues pruned to eliminate duplicates Z: 62 55.161 2.335 0.882 0.571 0.918 0.607 CB 1.634 62 residues pruned to eliminate duplicates Z: 116 87.174 2.357 0.982 0.626 0.930 0.652 CB 1.661 116 residues pruned to eliminate duplicates Z: 105 85.778 2.349 0.993 0.621 0.942 0.615 CB 1.701 105 residues pruned to eliminate duplicates Z: 150 94.779 2.350 0.924 0.616 0.933 0.658 CB 1.650 150 residues pruned to eliminate duplicates Z: 72 75.170 2.394 1.022 0.642 0.944 0.577 CB 1.710 72 residues pruned to eliminate duplicates Z: 13 8.479 1.773 0.723 0.235 0.833 0.417 CB 1.308 13 residues pruned to eliminate duplicates Z: 64 72.248 2.418 1.046 0.620 0.937 0.667 CB 1.754 64 residues pruned to eliminate duplicates Z: 148 89.248 2.340 0.915 0.617 0.898 0.619 CB 1.637 148 residues pruned to eliminate duplicates Z: 204 102.168 2.304 0.888 0.588 0.936 0.562 CB 1.618 204 residues pruned to eliminate duplicates Z: 102 91.405 2.380 1.067 0.655 0.931 0.663 CB 1.720 102 residues pruned to eliminate duplicates Z: 115 83.929 2.335 0.951 0.612 0.930 0.605 CB 1.669 115 residues pruned to eliminate duplicates Z: 129 88.084 2.335 0.905 0.617 0.938 0.617 CB 1.671 129 residues pruned to eliminate duplicates Z: 142 96.554 2.360 0.962 0.610 0.943 0.617 CB 1.678 142 residues pruned to eliminate duplicates Z: 167 85.108 2.275 0.907 0.539 0.916 0.578 CB 1.600 167 residues pruned to eliminate duplicates Z: 126 58.561 2.176 0.736 0.469 0.896 0.552 CB 1.598 126 residues pruned to eliminate duplicates Z: 23 37.213 2.347 1.054 0.637 0.818 0.636 CA 1.770 23 residues pruned to eliminate duplicates Z: 90 77.246 2.330 0.932 0.651 0.933 0.607 CB 1.694 90 residues pruned to eliminate duplicates Z: 128 91.389 2.362 0.963 0.639 0.913 0.606 CB 1.680 128 residues pruned to eliminate duplicates Z: 71 75.289 2.350 0.983 0.683 0.929 0.643 CB 1.759 71 residues pruned to eliminate duplicates Z: 86 86.762 2.368 1.013 0.688 0.976 0.659 CB 1.702 86 residues pruned to eliminate duplicates Z: 86 81.815 2.360 1.044 0.658 0.929 0.647 CB 1.710 86 residues pruned to eliminate duplicates Z: 33 53.906 2.380 1.092 0.633 0.906 0.688 CB 1.865 33 residues pruned to eliminate duplicates Z: 64 69.267 2.399 1.036 0.641 0.921 0.571 CB 1.700 64 residues pruned to eliminate duplicates Z: 84 78.371 2.352 0.943 0.649 0.952 0.639 CB 1.722 84 residues pruned to eliminate duplicates Z: 23 37.328 2.379 1.052 0.594 0.909 0.591 CA 1.639 23 residues pruned to eliminate duplicates Z: 91 81.354 2.310 1.061 0.640 0.933 0.611 CB 1.692 91 residues pruned to eliminate duplicates Z: 88 80.364 2.352 0.997 0.671 0.931 0.586 CB 1.682 88 residues pruned to eliminate duplicates Z: 75 72.192 2.333 1.022 0.662 0.919 0.649 CB 1.666 75 residues pruned to eliminate duplicates Z: 90 70.383 2.312 0.911 0.636 0.921 0.607 CB 1.613 90 residues pruned to eliminate duplicates Z: 64 76.437 2.443 1.086 0.640 0.937 0.683 CB 1.770 64 residues pruned to eliminate duplicates Z: 31 27.538 2.252 0.846 0.454 0.800 0.500 CB 1.586 31 residues pruned to eliminate duplicates Z: 74 62.099 2.266 0.903 0.632 0.932 0.685 CB 1.599 74 residues pruned to eliminate duplicates Z: 75 74.294 2.347 0.944 0.658 0.959 0.595 CB 1.703 75 residues pruned to eliminate duplicates Z: 89 75.074 2.328 0.971 0.645 0.909 0.591 CB 1.676 89 residues pruned to eliminate duplicates Z: 120 91.439 2.366 1.006 0.640 0.941 0.655 CB 1.646 120 residues pruned to eliminate duplicates Z: 87 69.232 2.285 0.985 0.623 0.919 0.628 CB 1.597 87 residues pruned to eliminate duplicates Z: 117 81.007 2.312 0.960 0.599 0.931 0.638 CB 1.623 117 residues pruned to eliminate duplicates Z: 24 18.870 2.075 0.803 0.441 0.870 0.609 CB 1.285 24 residues pruned to eliminate duplicates Z: 70 69.363 2.346 0.965 0.669 0.913 0.609 CB 1.698 70 residues pruned to eliminate duplicates Z: 67 63.602 2.297 0.954 0.640 0.970 0.652 CB 1.577 67 residues pruned to eliminate duplicates Z: 122 84.468 2.328 0.924 0.608 0.942 0.645 CB 1.642 122 residues pruned to eliminate duplicates Z: 51 47.381 2.204 0.833 0.683 0.900 0.680 CB 1.557 51 residues pruned to eliminate duplicates Z: 50 63.529 2.276 1.058 0.698 0.959 0.673 CB 1.686 50 residues pruned to eliminate duplicates Z: 88 69.601 2.330 0.932 0.623 0.908 0.540 CB 1.626 88 residues pruned to eliminate duplicates Z: 119 81.752 2.336 0.916 0.618 0.932 0.568 CB 1.613 119 residues pruned to eliminate duplicates Z: 87 74.178 2.331 0.925 0.631 0.919 0.581 CB 1.715 87 residues pruned to eliminate duplicates Z: 72 66.423 2.287 0.960 0.639 0.930 0.662 CB 1.660 72 residues pruned to eliminate duplicates Z: 86 72.549 2.305 0.940 0.625 0.941 0.624 CB 1.662 86 residues pruned to eliminate duplicates Z: 85 75.726 2.352 0.961 0.664 0.929 0.667 CB 1.658 85 residues pruned to eliminate duplicates Z: 73 76.669 2.326 1.062 0.665 0.944 0.681 CB 1.713 73 residues pruned to eliminate duplicates Z: 147 98.949 2.351 0.981 0.606 0.952 0.658 CB 1.670 147 residues pruned to eliminate duplicates Z: 71 69.147 2.329 0.920 0.666 0.929 0.643 CB 1.707 71 residues pruned to eliminate duplicates Z: 46 50.616 2.315 0.762 0.624 1.000 0.711 CB 1.645 46 residues pruned to eliminate duplicates Z: 70 60.475 2.314 0.943 0.633 0.870 0.623 CB 1.644 70 residues pruned to eliminate duplicates Z: 63 66.708 2.349 0.931 0.667 0.935 0.677 CB 1.710 63 residues pruned to eliminate duplicates Z: 125 84.264 2.319 0.974 0.587 0.935 0.597 CB 1.626 125 residues pruned to eliminate duplicates Z: 115 94.390 2.375 1.051 0.635 0.939 0.614 CB 1.705 115 residues pruned to eliminate duplicates Z: 87 82.042 2.359 0.990 0.650 0.953 0.628 CB 1.719 87 residues pruned to eliminate duplicates Z: 78 67.604 2.301 0.979 0.613 0.922 0.649 CB 1.649 78 residues pruned to eliminate duplicates Z: 90 68.246 2.314 0.922 0.597 0.910 0.596 CB 1.629 90 residues pruned to eliminate duplicates Z: 90 73.199 2.316 1.029 0.618 0.910 0.607 CB 1.622 90 residues pruned to eliminate duplicates Z: 227 95.522 2.278 0.837 0.545 0.925 0.575 CB 1.571 227 residues pruned to eliminate duplicates Z: 112 81.679 2.331 0.990 0.599 0.928 0.622 CB 1.639 112 residues pruned to eliminate duplicates Z: 144 93.996 2.352 0.984 0.599 0.930 0.615 CB 1.648 144 residues pruned to eliminate duplicates Z: 81 75.493 2.322 1.029 0.618 0.963 0.625 CB 1.664 81 residues pruned to eliminate duplicates Z: 56 50.443 2.245 0.879 0.650 0.909 0.673 CB 1.543 56 residues pruned to eliminate duplicates Z: 85 79.117 2.353 0.982 0.646 0.952 0.607 CB 1.696 85 residues pruned to eliminate duplicates Z: 74 66.435 2.322 0.961 0.593 0.945 0.589 CB 1.652 74 residues pruned to eliminate duplicates Z: 86 78.213 2.315 0.981 0.628 0.965 0.565 CB 1.700 86 residues pruned to eliminate duplicates Z: 85 72.013 2.323 0.911 0.620 0.964 0.643 CB 1.638 85 residues pruned to eliminate duplicates Z: 121 85.648 2.344 0.991 0.610 0.908 0.658 CB 1.661 121 residues pruned to eliminate duplicates Z: 77 75.643 2.316 1.060 0.617 0.947 0.671 CB 1.718 77 residues pruned to eliminate duplicates Z: 82 81.806 2.362 1.070 0.641 0.963 0.605 CB 1.692 82 residues pruned to eliminate duplicates Z: 34 37.113 2.232 0.746 0.536 0.970 0.515 CB 1.649 34 residues pruned to eliminate duplicates Z: 65 61.197 2.272 1.072 0.620 0.953 0.625 CB 1.522 65 residues pruned to eliminate duplicates Z: 83 75.366 2.341 1.046 0.631 0.915 0.610 CB 1.679 83 residues pruned to eliminate duplicates Z: 57 62.030 2.290 1.064 0.616 0.946 0.661 CB 1.660 57 residues pruned to eliminate duplicates Z: 165 95.130 2.318 0.911 0.572 0.951 0.640 CB 1.645 165 residues pruned to eliminate duplicates Z: 84 76.099 2.307 1.050 0.621 0.940 0.639 CB 1.677 84 residues pruned to eliminate duplicates Z: 84 78.294 2.339 1.065 0.623 0.940 0.663 CB 1.686 84 residues pruned to eliminate duplicates Z: 119 94.239 2.356 1.059 0.640 0.958 0.627 CB 1.638 119 residues pruned to eliminate duplicates Z: 61 56.064 2.247 0.984 0.613 0.950 0.650 CB 1.536 61 residues pruned to eliminate duplicates Z: 69 60.684 2.277 0.912 0.633 0.941 0.647 CB 1.585 69 residues pruned to eliminate duplicates Z: 18 29.383 2.322 0.872 0.507 0.941 0.647 CB 1.729 18 residues pruned to eliminate duplicates Z: 19 26.928 2.252 0.931 0.527 0.944 0.611 CB 1.506 19 residues pruned to eliminate duplicates Z: 154 96.107 2.335 0.936 0.583 0.954 0.654 CB 1.663 154 residues pruned to eliminate duplicates Z: 73 62.553 2.295 0.888 0.617 0.972 0.639 CB 1.567 73 residues pruned to eliminate duplicates Z: 18 31.751 2.312 1.151 0.572 0.882 0.706 CB 1.637 18 residues pruned to eliminate duplicates Z: 17 33.998 2.347 0.882 0.616 1.000 0.688 CB 1.725 17 residues pruned to eliminate duplicates Z: 121 89.259 2.321 1.014 0.633 0.942 0.600 CB 1.634 121 residues pruned to eliminate duplicates Z: 19 28.730 2.175 1.022 0.527 1.000 0.611 CB 1.499 19 residues pruned to eliminate duplicates Z: 19 28.612 2.236 0.765 0.526 1.000 0.667 CB 1.665 19 residues pruned to eliminate duplicates Z: 9 9.259 1.955 0.789 0.685 0.875 0.500 CB 0.903 9 residues pruned to eliminate duplicates Z: 8 16.561 2.097 0.865 0.730 0.857 0.857 CB 1.519 8 residues pruned to eliminate duplicates Z: 9 19.654 2.294 0.833 0.742 0.875 0.750 CB 1.521 9 residues pruned to eliminate duplicates Z: 8 13.656 2.178 0.860 0.743 0.857 0.857 CB 1.195 8 residues pruned to eliminate duplicates Z: 19 10.021 1.795 0.385 0.261 1.000 0.611 CB 1.248 19 residues pruned to eliminate duplicates Z: 19 9.820 1.794 0.430 0.242 0.889 0.444 CA 1.368 19 residues pruned to eliminate duplicates Z: 7 7.939 1.575 0.784 0.532 1.000 0.833 CB 1.118 7 residues pruned to eliminate duplicates Z: 18 8.106 1.780 0.365 0.242 0.882 0.529 CB 1.236 18 residues pruned to eliminate duplicates Z: 90 51.046 2.134 0.764 0.527 0.910 0.573 CB 1.537 90 residues pruned to eliminate duplicates Z: 144 75.845 2.176 0.798 0.581 0.923 0.601 CB 1.624 144 residues pruned to eliminate duplicates Z: 158 78.623 2.196 0.764 0.584 0.930 0.618 CB 1.608 158 residues pruned to eliminate duplicates Z: 145 71.712 2.178 0.791 0.570 0.938 0.625 CB 1.527 145 residues pruned to eliminate duplicates Z: 34 25.189 1.900 0.660 0.529 0.970 0.606 CB 1.393 34 residues pruned to eliminate duplicates Z: 39 21.300 1.929 0.452 0.493 0.868 0.553 CB 1.430 39 residues pruned to eliminate duplicates Z: 34 26.282 1.976 0.570 0.480 1.000 0.667 CB 1.505 34 residues pruned to eliminate duplicates Z: 60 49.984 2.199 0.771 0.580 0.966 0.593 CB 1.601 60 residues pruned to eliminate duplicates Z: 62 45.354 2.178 0.749 0.541 0.951 0.590 CB 1.541 62 residues pruned to eliminate duplicates Z: 159 78.131 2.182 0.744 0.580 0.949 0.652 CB 1.592 159 residues pruned to eliminate duplicates Z: 39 20.346 1.906 0.473 0.440 0.921 0.605 CB 1.358 39 residues pruned to eliminate duplicates Z: 73 46.886 2.123 0.769 0.529 0.931 0.639 CB 1.536 73 residues pruned to eliminate duplicates Z: 31 18.503 1.906 0.407 0.554 0.900 0.633 CB 1.329 31 residues pruned to eliminate duplicates Z: 103 59.454 2.160 0.785 0.551 0.931 0.618 CB 1.560 103 residues pruned to eliminate duplicates Z: 153 77.597 2.186 0.813 0.600 0.914 0.651 CB 1.579 153 residues pruned to eliminate duplicates Z: 68 44.909 2.090 0.774 0.550 0.940 0.657 CB 1.499 68 residues pruned to eliminate duplicates Z: 29 19.294 1.938 0.612 0.534 0.821 0.643 CB 1.374 29 residues pruned to eliminate duplicates Z: 157 73.487 2.172 0.735 0.553 0.936 0.603 CB 1.584 157 residues pruned to eliminate duplicates Z: 40 20.642 1.854 0.463 0.453 0.923 0.487 CB 1.386 40 residues pruned to eliminate duplicates Z: 54 29.135 2.010 0.605 0.467 0.906 0.547 CB 1.417 54 residues pruned to eliminate duplicates Z: 95 52.840 2.125 0.746 0.528 0.947 0.628 CB 1.509 95 residues pruned to eliminate duplicates Z: 38 22.193 1.919 0.509 0.458 0.946 0.541 CB 1.390 38 residues pruned to eliminate duplicates Z: 152 80.962 2.218 0.792 0.597 0.927 0.649 CB 1.629 152 residues pruned to eliminate duplicates Z: 39 22.282 1.954 0.466 0.460 0.895 0.579 CB 1.468 38 residues pruned to eliminate duplicates Z: 16 18.549 1.887 0.633 0.706 0.933 0.800 CA 1.381 16 residues pruned to eliminate duplicates Z: 88 54.210 2.194 0.759 0.544 0.908 0.644 CB 1.589 88 residues pruned to eliminate duplicates Z: 75 58.730 2.231 0.859 0.604 0.919 0.703 CB 1.624 75 residues pruned to eliminate duplicates Z: 71 47.119 2.121 0.735 0.518 0.957 0.614 CB 1.570 71 residues pruned to eliminate duplicates Z: 138 78.761 2.231 0.794 0.603 0.920 0.635 CB 1.657 138 residues pruned to eliminate duplicates Z: 115 82.475 2.284 0.915 0.633 0.930 0.596 CB 1.676 115 residues pruned to eliminate duplicates Z: 154 82.728 2.203 0.829 0.591 0.941 0.608 CB 1.617 154 residues pruned to eliminate duplicates Z: 118 84.938 2.279 0.922 0.632 0.949 0.624 CB 1.669 118 residues pruned to eliminate duplicates Z: 137 79.954 2.236 0.792 0.608 0.949 0.684 CB 1.628 137 residues pruned to eliminate duplicates Z: 58 46.524 2.198 0.852 0.560 0.895 0.649 CB 1.595 58 residues pruned to eliminate duplicates Z: 121 80.933 2.263 0.882 0.632 0.908 0.633 CB 1.687 121 residues pruned to eliminate duplicates Z: 38 43.715 2.252 0.986 0.549 0.946 0.568 CB 1.620 38 residues pruned to eliminate duplicates Z: 95 60.338 2.194 0.795 0.581 0.915 0.596 CB 1.597 95 residues pruned to eliminate duplicates Z: 135 86.276 2.253 0.854 0.627 0.963 0.679 CB 1.645 135 residues pruned to eliminate duplicates Z: 153 76.357 2.192 0.751 0.584 0.914 0.612 CB 1.627 153 residues pruned to eliminate duplicates Z: 106 63.273 2.165 0.837 0.540 0.952 0.619 CB 1.567 106 residues pruned to eliminate duplicates Z: 37 44.905 2.264 1.062 0.565 0.917 0.583 CB 1.641 37 residues pruned to eliminate duplicates Z: 55 55.370 2.316 1.040 0.589 0.907 0.611 CB 1.614 55 residues pruned to eliminate duplicates Z: 74 40.261 2.115 0.703 0.500 0.849 0.575 CB 1.540 74 residues pruned to eliminate duplicates Z: 133 74.731 2.217 0.836 0.599 0.894 0.591 CB 1.626 133 residues pruned to eliminate duplicates Z: 71 42.653 2.096 0.754 0.506 0.900 0.486 CB 1.533 71 residues pruned to eliminate duplicates Z: 36 47.308 2.297 1.023 0.578 0.971 0.543 CB 1.643 36 residues pruned to eliminate duplicates Z: 68 48.355 2.160 0.832 0.522 0.925 0.582 CB 1.578 68 residues pruned to eliminate duplicates Z: 114 84.769 2.282 0.967 0.622 0.929 0.602 CB 1.704 114 residues pruned to eliminate duplicates Z: 138 75.148 2.188 0.793 0.595 0.920 0.606 CB 1.625 138 residues pruned to eliminate duplicates Z: 140 80.855 2.223 0.867 0.568 0.942 0.547 CB 1.642 140 residues pruned to eliminate duplicates Z: 141 80.136 2.192 0.848 0.598 0.921 0.600 CB 1.652 141 residues pruned to eliminate duplicates Z: 141 85.411 2.237 0.874 0.621 0.929 0.621 CB 1.654 141 residues pruned to eliminate duplicates Z: 118 72.728 2.241 0.862 0.601 0.897 0.573 CB 1.632 118 residues pruned to eliminate duplicates Z: 121 78.744 2.255 0.879 0.620 0.917 0.542 CB 1.653 121 residues pruned to eliminate duplicates Z: 121 81.238 2.264 0.864 0.617 0.942 0.608 CB 1.671 121 residues pruned to eliminate duplicates Z: 129 83.186 2.233 0.890 0.615 0.945 0.594 CB 1.653 129 residues pruned to eliminate duplicates Z: 144 80.800 2.231 0.862 0.606 0.902 0.587 CB 1.630 144 residues pruned to eliminate duplicates Z: 28 36.226 2.265 0.946 0.554 0.926 0.481 CA 1.621 28 residues pruned to eliminate duplicates Z: 66 46.124 2.170 0.786 0.531 0.923 0.523 CB 1.551 66 residues pruned to eliminate duplicates Z: 121 83.297 2.263 0.937 0.625 0.942 0.617 CB 1.638 121 residues pruned to eliminate duplicates Z: 121 81.020 2.259 0.893 0.614 0.933 0.600 CB 1.663 121 residues pruned to eliminate duplicates Z: 139 78.914 2.220 0.880 0.585 0.920 0.587 CB 1.612 139 residues pruned to eliminate duplicates Z: 141 80.886 2.208 0.842 0.614 0.936 0.571 CB 1.613 141 residues pruned to eliminate duplicates Z: 84 63.069 2.266 0.734 0.640 0.916 0.627 CB 1.687 84 residues pruned to eliminate duplicates Z: 133 79.198 2.216 0.858 0.616 0.939 0.644 CB 1.597 133 residues pruned to eliminate duplicates Z: 91 64.437 2.226 0.784 0.620 0.922 0.589 CB 1.656 91 residues pruned to eliminate duplicates Z: 86 52.750 2.145 0.829 0.570 0.906 0.600 CB 1.505 86 residues pruned to eliminate duplicates Z: 110 62.395 2.176 0.795 0.566 0.899 0.615 CB 1.597 110 residues pruned to eliminate duplicates Z: 85 66.961 2.266 0.763 0.647 0.952 0.667 CB 1.674 85 residues pruned to eliminate duplicates Z: 90 69.006 2.232 0.837 0.645 0.955 0.663 CB 1.632 90 residues pruned to eliminate duplicates Z: 89 64.701 2.243 0.784 0.656 0.909 0.591 CB 1.640 89 residues pruned to eliminate duplicates Z: 86 67.415 2.251 0.785 0.640 0.953 0.635 CB 1.676 86 residues pruned to eliminate duplicates Z: 149 84.390 2.218 0.888 0.596 0.926 0.622 CB 1.633 149 residues pruned to eliminate duplicates Z: 111 71.423 2.177 0.869 0.597 0.936 0.609 CB 1.629 111 residues pruned to eliminate duplicates Z: 71 61.344 2.246 0.852 0.649 0.914 0.629 CB 1.678 71 residues pruned to eliminate duplicates Z: 87 62.730 2.254 0.885 0.609 0.907 0.616 CB 1.582 87 residues pruned to eliminate duplicates Z: 88 69.119 2.237 0.816 0.656 0.954 0.678 CB 1.654 88 residues pruned to eliminate duplicates Z: 64 63.335 2.262 0.856 0.716 0.937 0.698 CB 1.670 64 residues pruned to eliminate duplicates Z: 88 69.415 2.235 0.855 0.652 0.931 0.621 CB 1.674 88 residues pruned to eliminate duplicates Z: 114 81.769 2.266 0.958 0.626 0.920 0.611 CB 1.672 114 residues pruned to eliminate duplicates Z: 141 84.983 2.242 0.866 0.623 0.929 0.614 CB 1.646 141 residues pruned to eliminate duplicates Z: 82 72.438 2.277 0.855 0.654 0.963 0.654 CB 1.714 82 residues pruned to eliminate duplicates Z: 84 71.000 2.267 0.877 0.669 0.928 0.699 CB 1.688 84 residues pruned to eliminate duplicates Z: 16 30.617 2.245 0.967 0.588 0.933 0.600 CB 1.763 16 residues pruned to eliminate duplicates Z: 66 63.230 2.251 0.922 0.682 0.923 0.646 CB 1.662 66 residues pruned to eliminate duplicates Z: 73 59.854 2.231 0.824 0.629 0.944 0.625 CB 1.626 73 residues pruned to eliminate duplicates Z: 107 58.252 2.153 0.703 0.563 0.915 0.594 CB 1.585 107 residues pruned to eliminate duplicates Z: 102 84.594 2.285 0.958 0.661 0.960 0.663 CB 1.687 102 residues pruned to eliminate duplicates Z: 125 77.203 2.234 0.858 0.604 0.935 0.589 CB 1.618 125 residues pruned to eliminate duplicates Z: 89 64.861 2.239 0.764 0.642 0.920 0.636 CB 1.666 89 residues pruned to eliminate duplicates Z: 85 72.982 2.254 0.838 0.659 0.976 0.655 CB 1.700 85 residues pruned to eliminate duplicates Z: 107 79.438 2.245 0.966 0.641 0.925 0.642 CB 1.657 107 residues pruned to eliminate duplicates Z: 91 67.123 2.207 0.845 0.624 0.944 0.578 CB 1.637 91 residues pruned to eliminate duplicates Z: 137 75.184 2.203 0.778 0.598 0.941 0.676 CB 1.592 137 residues pruned to eliminate duplicates Z: 89 68.663 2.232 0.796 0.641 0.943 0.636 CB 1.697 89 residues pruned to eliminate duplicates Z: 85 69.279 2.241 0.843 0.641 0.952 0.643 CB 1.684 85 residues pruned to eliminate duplicates Z: 54 62.578 2.252 0.916 0.673 0.981 0.698 CA 1.732 54 residues pruned to eliminate duplicates Z: 133 80.013 2.213 0.871 0.610 0.924 0.644 CB 1.639 133 residues pruned to eliminate duplicates Z: 84 68.025 2.253 0.831 0.652 0.928 0.602 CB 1.693 84 residues pruned to eliminate duplicates Z: 74 64.245 2.242 0.877 0.643 0.932 0.658 CB 1.678 74 residues pruned to eliminate duplicates Z: 64 62.587 2.250 0.850 0.647 0.952 0.667 CA 1.733 64 residues pruned to eliminate duplicates Z: 73 61.152 2.233 0.843 0.614 0.944 0.625 CB 1.664 73 residues pruned to eliminate duplicates Z: 46 48.643 2.192 0.816 0.655 0.978 0.756 CA 1.613 46 residues pruned to eliminate duplicates Z: 89 71.461 2.247 0.842 0.650 0.955 0.659 CB 1.676 89 residues pruned to eliminate duplicates Z: 89 65.788 2.213 0.808 0.643 0.943 0.670 CB 1.626 89 residues pruned to eliminate duplicates Z: 122 80.385 2.251 0.946 0.605 0.917 0.529 CB 1.646 122 residues pruned to eliminate duplicates Z: 120 84.009 2.278 0.932 0.628 0.941 0.622 CB 1.649 120 residues pruned to eliminate duplicates Z: 121 72.323 2.189 0.944 0.570 0.908 0.517 CB 1.596 121 residues pruned to eliminate duplicates Z: 74 54.679 2.181 0.855 0.610 0.904 0.726 CB 1.577 74 residues pruned to eliminate duplicates Z: 50 47.470 2.251 0.793 0.612 0.898 0.571 CB 1.683 50 residues pruned to eliminate duplicates Z: 155 79.672 2.187 0.811 0.581 0.922 0.636 CB 1.627 155 residues pruned to eliminate duplicates Z: 83 72.752 2.281 0.897 0.649 0.951 0.622 CB 1.699 83 residues pruned to eliminate duplicates Z: 70 73.700 2.252 1.039 0.701 0.957 0.652 CB 1.683 70 residues pruned to eliminate duplicates Z: 106 85.195 2.278 0.967 0.651 0.962 0.610 CB 1.676 106 residues pruned to eliminate duplicates Z: 50 48.187 2.221 0.812 0.625 0.918 0.531 CA 1.656 50 residues pruned to eliminate duplicates Z: 89 72.056 2.229 0.869 0.652 0.955 0.602 CB 1.678 89 residues pruned to eliminate duplicates Z: 97 62.205 2.175 0.793 0.601 0.917 0.604 CB 1.613 97 residues pruned to eliminate duplicates Z: 121 85.030 2.241 0.955 0.623 0.958 0.600 CB 1.646 121 residues pruned to eliminate duplicates Z: 84 67.720 2.257 0.819 0.641 0.940 0.663 CB 1.688 84 residues pruned to eliminate duplicates Z: 83 76.567 2.249 1.028 0.643 0.976 0.634 CB 1.663 90 residues pruned to eliminate duplicates Z: 10 18.699 2.132 0.856 0.761 0.889 0.667 CA 1.406 10 residues pruned to eliminate duplicates Z: 144 84.510 2.215 0.901 0.612 0.930 0.622 CB 1.623 138 residues pruned to eliminate duplicates Z: 10 18.364 2.137 0.766 0.653 1.000 0.444 CA 1.407 10 residues pruned to eliminate duplicates Z: 89 67.606 2.217 0.911 0.619 0.920 0.602 CB 1.652 89 residues pruned to eliminate duplicates Z: 13 17.805 2.195 0.954 0.511 0.833 0.500 CA 1.422 13 residues pruned to eliminate duplicates Z: 70 62.937 2.216 0.992 0.630 0.913 0.609 CB 1.663 70 residues pruned to eliminate duplicates Z: 58 56.479 2.182 0.982 0.620 0.930 0.596 CB 1.661 58 residues pruned to eliminate duplicates Z: 152 86.186 2.221 0.864 0.606 0.940 0.636 CB 1.629 152 residues pruned to eliminate duplicates Z: 88 70.766 2.258 0.917 0.631 0.931 0.655 CB 1.664 88 residues pruned to eliminate duplicates Z: 122 83.624 2.245 0.985 0.629 0.942 0.636 CB 1.604 122 residues pruned to eliminate duplicates Z: 146 87.997 2.214 0.890 0.614 0.952 0.614 CB 1.647 146 residues pruned to eliminate duplicates Z: 150 73.966 2.143 0.846 0.553 0.926 0.550 CB 1.570 154 residues pruned to eliminate duplicates Z: 6 7.311 1.677 1.075 0.362 0.800 0.600 N 1.362 6 residues pruned to eliminate duplicates Z: 159 83.922 2.181 0.867 0.591 0.949 0.589 CB 1.582 159 residues pruned to eliminate duplicates Z: 21 20.567 2.007 0.643 0.531 0.950 0.550 CB 1.423 21 residues pruned to eliminate duplicates Z: 74 60.915 2.205 0.831 0.643 0.945 0.616 CB 1.635 74 residues pruned to eliminate duplicates Z: 85 70.192 2.248 0.923 0.649 0.929 0.643 CB 1.659 85 residues pruned to eliminate duplicates Z: 88 64.406 2.249 0.907 0.557 0.920 0.540 CB 1.656 88 residues pruned to eliminate duplicates Z: 84 73.259 2.265 0.921 0.671 0.940 0.687 CB 1.679 84 residues pruned to eliminate duplicates Z: 85 71.490 2.248 0.910 0.650 0.940 0.655 CB 1.680 85 residues pruned to eliminate duplicates Z: 121 88.188 2.278 0.966 0.640 0.958 0.642 CB 1.645 121 residues pruned to eliminate duplicates Z: 10 10.673 1.940 0.548 0.603 0.778 0.778 CB 1.381 Z: 7 2.593 1.334 0.413 0.360 0.667 0.500 CA 0.979 7 residues pruned to eliminate duplicates Z: 9 10.603 1.828 0.803 0.558 0.750 0.500 CB 1.433 9 residues pruned to eliminate duplicates 629 residues left after pruning, divided into chains as follows: A: 6 B: 19 C: 7 D: 6 E: 7 F: 7 G: 7 H: 7 I: 8 J: 8 K: 11 L: 27 M: 38 N: 49 O: 38 P: 230 Q: 154 CC for partial structure against native data = 25.45 % ------------------------------------------------------------------------------ Global autotracing cycle 5 Phases from autotracing cycle 2 used as input for final density modification = 0.300, Contrast = 0.469, Connect. = 0.713 for dens.mod. cycle 1 = 0.300, Contrast = 0.545, Connect. = 0.740 for dens.mod. cycle 2 = 0.300, Contrast = 0.644, Connect. = 0.777 for dens.mod. cycle 3 = 0.300, Contrast = 0.653, Connect. = 0.779 for dens.mod. cycle 4 = 0.300, Contrast = 0.667, Connect. = 0.783 for dens.mod. cycle 5 = 0.300, Contrast = 0.674, Connect. = 0.786 for dens.mod. cycle 6 = 0.300, Contrast = 0.682, Connect. = 0.788 for dens.mod. cycle 7 = 0.300, Contrast = 0.686, Connect. = 0.790 for dens.mod. cycle 8 = 0.300, Contrast = 0.691, Connect. = 0.791 for dens.mod. cycle 9 = 0.300, Contrast = 0.692, Connect. = 0.792 for dens.mod. cycle 10 Estimated mean FOM and mapCC as a function of resolution d inf - 4.05 - 3.21 - 2.80 - 2.55 - 2.36 - 2.22 - 2.11 - 2.02 - 1.94 - 1.86 0.691 0.745 0.747 0.727 0.694 0.670 0.667 0.650 0.534 0.511 0.846 0.908 0.916 0.897 0.866 0.874 0.850 0.808 0.716 0.692 N 9501 9506 9563 9231 9867 9555 9459 9275 9766 8747 Estimated mean FOM = 0.665 Pseudo-free CC = 67.87 % TimeTaking 617.2